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Temperatura (K) Constante de Equilibrio Keq: Desviaciòn Coeficiente de Corelaciòn

The document contains experimental data from studies measuring the constant of equilibrium (Keq) at different temperatures. It also includes graphs of Keq versus temperature and plots of reaction rate (R) versus time or temperature derived from polynomial fits to the data. Additional tables provide kinetic data measuring the natural log of 1-R over time at different temperatures, which are used to calculate average rate constants (k).

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44 views27 pages

Temperatura (K) Constante de Equilibrio Keq: Desviaciòn Coeficiente de Corelaciòn

The document contains experimental data from studies measuring the constant of equilibrium (Keq) at different temperatures. It also includes graphs of Keq versus temperature and plots of reaction rate (R) versus time or temperature derived from polynomial fits to the data. Additional tables provide kinetic data measuring the natural log of 1-R over time at different temperatures, which are used to calculate average rate constants (k).

Uploaded by

hgcu
Copyright
© © All Rights Reserved
We take content rights seriously. If you suspect this is your content, claim it here.
Available Formats
Download as XLS, PDF, TXT or read online on Scribd
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Desviacin

Coeficiente de Corelacin

Temperatura (K)

Constante de Equilibrio Keq

1000
1100
1200
1300
1400
1500

3.41
161
4030
61100
629000
4750000

1364653.186
0.723

5000000

4500000

4000000

3500000

3000000

2500000

2000000

1500000

f(x) = 0.0006234959x^4 - 2.9404441312x^3 + 5179.904630934x^2 - 4039090.84821


R = 0.998956918

2500000

2000000

1500000

1000000

500000

0
0

200

400

600

800

1000

1200

1400

160

4630934x^2 - 4039090.84821147x + 1176143070.09702

Tabla 2
Polynomial (Tabla 2)

Polynomial (Tabla 2)

1200

1400

1600

T (C)

0.02
0.035
0.08
0.12
0.155
0.175
0.19
0.185

800
900
950
1000
1050
1100
1200
1300

0.2

f(x) = 2.51214159801467E-011x^4 - 1.0978686748772E-007x^3 + 0.0001772489x^2 - 0.1248286727


0.18
R = 0.9991593306
0.16

0.14
0.12
0.1
0.08
0.06
0.04
0.02
0
700

T (C)
800

900

1000

1100

1200

1300

1400

001772489x^2 - 0.1248286727x + 32.3643620586

00

Column C
Polynomial
(Column C)

1300

1400

R
1200 C

Time min

LN(1-R)

t^0,5

a= LN(1-R)/t^0,5

log a

0.85
0.94
0.96
0.97
0.98
0.99

5
10
15
30
60
90

1.8971199849

2.2360679775

0.8484178495

-0.0713902031

2.8134107168

3.1622776602

0.8896785858

-0.0507668626

3.2188758249

3.8729833462

0.8311101642

-0.0803414064

3.5065578973

5.4772255751

0.6402069532

-0.1936796134

3.9120230054

7.7459666924

0.5050399983

-0.2966742251

4.605170186

9.4868329805

0.48542756

-0.3138755704

K promedio

1100 C

Time min

LN(1-R)

t^0,5

a= LN(1-R)/t^0,5

log a

0.4
0.58
0.65
0.84
0.87
0.89

5
10
15
30
60
90

0.5108256238

2.2360679775

0.2284481639

-0.6412123282

0.8675005677

3.1622776602

0.2743277665

-0.5617302323

1.0498221245

3.8729833462

0.271062907

-0.5669299085

1.8325814637

5.4772255751

0.3345820687

-0.4754973379

2.0402208285

7.7459666924

0.2633913764

-0.5793984482

2.2072749132

9.4868329805

0.2326672049

-0.6332648274

K promedio

1050 C

Time min

LN(1-R)

t^0,5

a= LN(1-R)/t^0,5

log a

0.17
0.35
0.44
0.56
0.68
0.77

5
10
15
30
60
90

0.1863295782

2.2360679775

0.0833291206

-1.0792032013

0.4307829161

3.1622776602

0.1362255192

-0.8657415282

0.5798184953

3.8729833462

0.1497084917

-0.824753565

0.8209805521

5.4772255751

0.1498898559

-0.824227758

1.1394342832

7.7459666924

0.1471003334

-0.8323863429

1.4696759701

9.4868329805

0.1549174496

-0.8098996614

K promedio

1000 C

Time min

LN(1-R)

t^0,5

a= LN(1-R)/t^0,5

log a

0.1
0.2
0.29
0.37
0.5
0.55

5
10
15
30
60
90

0.1053605157

2.2360679775

0.047118655

-1.3268071147

0.2231435513

3.1622776602

0.0705641867

-1.1514156594

0.3424903089

3.8729833462

0.0884306175

-1.0533973423

0.4620354596

5.4772255751

0.0843557479

-1.07388532

0.6931471806

7.7459666924

0.0894849162

-1.0482501641

0.7985076962

9.4868329805

0.0841701016

-1.0748421484

K promedio

950 C

Time min

LN(1-R)

t^0,5

a= LN(1-R)/t^0,5

log a

0.1
0.13
0.15
0.2
0.3
0.37

5
10
15
30
60
90

0.1053605157

2.2360679775

0.047118655

-1.3268071147

0.1392620673

3.1622776602

0.0440385324

-1.356167162

0.1625189295

3.8729833462

0.0419622072

-1.3771416765

0.2231435513

5.4772255751

0.0407402522

-1.3899762868

0.3566749439

7.7459666924

0.0460465373

-1.3368030235

0.4620354596

9.4868329805

0.0487028137

-1.3124459473

K promedio

900 C

Time min

LN(1-R)

t^0,5

a= LN(1-R)/t^0,5

log a

0.01
0.05
0.1

5
10
15

0.0100503359

2.2360679775

0.0044946468

-2.3473044273

0.0512932944

3.1622776602

0.0162203639

-1.7899394068

0.1053605157

3.8729833462

0.0272039682

-1.565367742

0.11
0.13
0.14

30
60
90

0.1165338163

5.4772255751

0.0212760666

-1.6721086584

0.1392620673

7.7459666924

0.0179786556

-1.7452427872

0.1508228897

9.4868329805

0.0158981285

-1.7986539972

K promedio

800 C

Time min

LN(1-R)

t^0,5

a= LN(1-R)/t^0,5

log a

0.01
0.015
0.02
0.03
0.04
0.045

5
10
15
30
60
90

0.0100503359

2.2360679775

0.0044946468

-2.3473044273

0.0151136378

3.1622776602

0.0047793519

-2.3206309896

0.0202027073

3.8729833462

0.0052163166

-2.2826360574

0.0304592075

5.4772255751

0.005561065

-2.2548420281

0.0408219945

7.7459666924

0.0052700968

-2.2781814051

0.0460439385

9.4868329805

0.0048534573

-2.3139487895

K promedio

1
f(x) = - 1.01639185553197E-007x^4 + 1.9688230658884E-005x^3 - 0.00125
R = 0.984626381
0.9

0.8

0.7

0.6

0.5

0.4

0.3

0.2

0.4

0.3

0.2

0.1

10

20

30

40
50
60
tiempo (min)

70

80

90

(log a )/ 0.5

-0.1427804062

0.7198128474

-0.1015337251

0.7915279861

-0.1606828127

0.6907441051

-0.3873592267

0.4098649429

-0.5933484502

0.2550653999

-0.6277511407

0.235639916

0.7556704168
(log a )/ 0.5

-1.2824246564

0.05219

-1.1234604647

0.07526

-1.1338598169

0.07348

-0.9509946758

0.11195

-1.1587968965

0.06938

-1.2665296548

0.05413

0.07191
(log a )/ 0.5

-2.1584064027

0.0069437423

-1.7314830564

0.0185573921

-1.64950713

0.0224126325

-1.6484555159

0.0224669689

-1.6647726857

0.0216385081

-1.6197993228

0.0239994162

0.0218149836
(log a )/ 0.5

-2.6536142294

0.0022201677

-2.3028313189

0.0049793044

-2.1067946845

0.0078199741

-2.1477706399

0.0071158922

-2.0965003283

0.0080075502

-2.1496842968

0.007084606

0.0062045824
(log a )/ 0.5

-2.6536142294

0.0022201677

-2.7123343241

0.0019393923

-2.7542833531

0.0017608268

-2.7799525736

0.0016597681

-2.6736060471

0.0021202836

-2.6248918946

0.0023719641

0.0020120671
(log a )/ 0.5

-4.6946088546 2.0201850E-005
-3.5798788137

0.0002631002

-3.1307354841

0.0007400559

-3.3442173167

0.000452671

-3.4904855745

0.0003232321

-3.5973079944

0.0002527505

0.0003420019
(log a )/ 0.5

-4.6946088546 2.0201850E-005
-4.6412619792 2.2842205E-005
-4.5652721148

0.00002721

-4.5096840562 3.0925444E-005
-4.5563628102 2.7773921E-005
-4.6278975791

0.000023556

2.54182E-005

884E-005x^3 - 0.0012581048x^2 + 0.0307499094x + 0.7289604469

1200 C
Polynomial (1200 C)
1100 C
1050 C
1000 C
950 C
900 C
800 C

800 C

70

80

90

100

R
1200 C

Time min

LN(1-R)

Ln(-ln(1-r))

ln t

0.85
0.94
0.96
0.97
0.98
0.99

5
10
15
30
60
90

1.8971199849

0.6403369388

1.6094379124

2.8134107168

1.0343975255

2.302585093

3.2188758249

1.1690321759

2.7080502011

3.5065578973

1.2546349003

3.4011973817

3.9120230054

1.3640546329

4.0943445622

4.605170186

1.5271796258

4.4998096703

1100 C

Time min

LN(1-R)

Ln(-ln(1-r))

ln t

0.4
0.58
0.65
0.84
0.87
0.89

5
10
15
30
60
90

0.5108256238

-0.6717269921

1.6094379124

0.8675005677

-0.1421391127

2.302585093

1.0498221245

0.0486207446

2.7080502011

1.8325814637

0.6057256088

3.4011973817

2.0402208285

0.7130580513

4.0943445622

2.2072749132

0.7917586837

4.4998096703

1050 C

Time min

LN(1-R)

Ln(-ln(1-r))

ln t

0.17
0.35
0.44
0.56
0.68
0.77

5
10
15
30
60
90

0.1863295782

-1.6802382475

1.6094379124

0.4307829161

-0.8421509907

2.302585093

0.5798184953

-0.5450401636

2.7080502011

0.8209805521

-0.1972558579

3.4011973817

1.1394342832

0.1305318964

4.0943445622

1.4696759701

0.385041948

4.4998096703

1000 C

Time min

LN(1-R)

Ln(-ln(1-r))

ln t

0.1
0.2
0.29
0.37
0.5
0.55

5
10
15
30
60
90

0.1053605157

-2.2503673273

1.6094379124

0.2231435513

-1.4999399868

2.302585093

0.3424903089

-1.0715119167

2.7080502011

950 C

Time min

LN(1-R)

Ln(-ln(1-r))

ln t

0.1
0.13
0.15
0.2
0.3
0.37

5
10
15
30
60
90

0.1053605157

-2.2503673273

1.6094379124

0.1392620673

-1.9713977444

2.302585093

0.1625189295

-1.8169607948

2.7080502011

0.2231435513

-1.4999399868

3.4011973817

0.3566749439

-1.0309304332

4.0943445622

0.4620354596

-0.7721136385

4.4998096703

900 C

Time min

LN(1-R)

Ln(-ln(1-r))

ln t

0.01
0.05
0.1

5
10
15

0.0100503359

-4.6001492268

1.6094379124

0.4620354596

-0.7721136385

3.4011973817

0.6931471806

-0.3665129206

4.0943445622

0.7985076962

-0.225010673

4.4998096703

0.0512932944

-2.970195249

2.302585093

0.1053605157

-2.2503673273

2.7080502011

0.11
0.13
0.14

30
60
90

800 C

Time min

LN(1-R)

Ln(-ln(1-r))

ln t

0.01
0.015
0.02
0.03
0.04
0.045

5
10
15
30
60
90

0.0100503359

-4.6001492268

1.6094379124

0.1165338163

-2.1495737798

3.4011973817

0.1392620673

-1.9713977444

4.0943445622

0.1508228897

-1.8916490462

4.4998096703

0.0151136378

-4.1921577765

2.302585093

0.0202027073

-3.9019386579

2.7080502011

0.0304592075

-3.4913669501

3.4011973817

0.0408219945

-3.1985342614

4.0943445622

0.0460439385

-3.0781591536

4.4998096703

Ln(-ln(1-R))

f(x) = 0.2671867539x + 0.3359734783


R = 0.9166682859
1
f(x) = 0.5110393501x - 1.3613196032
R = 0.9436671869
f(x) = 0.6621509362x - 2.5125553981
R = 0.9562217549

0
1

-1

-2

-3

-4

-5

1.5

2
2.5
f(x) = 0.6734219468x
- 3.1202486812
R = 0.95713857

f(x) = 0.5131811206x - 3.1491324158


R = 0.9859035609
f(x) = 0.8086389758x - 5.1477484059
R = 0.7393882076

f(x) = 0.5365058108x - 5.4082649356


R = 0.9875141485

3.

-5

3.5

ln t

4.5

5
1200 C
Linear (1200
C)
Linear (1200
C)
1100 C
Linear (1100
C)
1050 C
Linear (1050
C)
1000 C
Linear (1000
C)
950 C
Linear (950
C)
900 C
Linear (900
C)
800 C

800 C

Ea = 85

kcal/mol

R
8.5
8.5
8.5
8.5
8.5
8.5
8.5
8.5

f(x) = - 4.25166141
0.0000 R = 0.9983650884
6.5
7.0

-2.0000

-4.0000

-6.0000

-8.0000

-10.0000

-12.0000

T (C)

T (K)

Constante de Equilibrio Keq

ln k

Ea/R

800
900
950
1000
1050
1100
1200
1300

1073
1173
1223
1273
1323
1373
1473

0.0000154
0.000342
0.00199
0.00775
0.0217
0.0702
0.774

-11.0811
-7.9807
-6.2196
-4.8601
-3.8304
-2.6564
-0.2562

-10000.0000
-10000.0000
-10000.0000
-10000.0000
-10000.0000
-10000.0000
-10000.0000

f(x) = - 4.2516614123x + 28.4450284567


0.0000 R = 0.9983650884
6.5
7.0
7.5

8.0

8.5

9.0

9.5

-2.0000

-4.0000

Col
-6.0000

-8.0000

-10.0000

-12.0000

1/T
0.0009
0.0009
0.0008
0.0008
0.0008
0.0007
0.0007

9.0

-9.3197
-8.5251
-8.1766
-7.8555
-7.5586
-7.2833
-6.7889

9.5

Column H

lnk

1/T*10000

-20.4008
-16.5058
-14.3962
-12.7155
-11.3890
-9.9397
-7.0450

9.3
8.5
8.2
7.9
7.6
7.3
6.8

lnk=
T (C)

T (K)

800

1073

T (C)

T (K)

850

1123

T (C)

T (K)

900

1173

T (C)

T (K)

950

1223

T (C)

T (K)

1000

1273

T (C)

T (K)

1050

1323

1/T

lnk

0.000931966 -11.1794175 1.39586E-005

1/T

lnk

0.000890472 -9.4151959 8.14765E-005

1/T

lnk

0.000852515 -7.80137681 0.0004091712

1/T

lnk

0.000817661 -6.31951349 0.0018008194

1/T

lnk

0.000785546 -4.95405734 0.0070547273

1/T

lnk

0.000755858 -3.69181028 0.0249268366

28.445
t (min)
5
10
15
30
60
90

t (min)
5
10
15
30
60
90

t (min)
5
10
15
30
60
90

t (min)
5
10
15
30
60
90

t (min)
5
10
15
30
60
90

t (min)
5
10
15
30
60
90

T (C)

T (K)

1100

1373

T (C)

T (K)

1150

1423

T (C)

T (K)

1200

1473

T (C)

T (K)

1250

1523

T (C)

T (K)

1300

1573

1.00000000

0.90000000

1/T

lnk

0.000728332 -2.52149672 0.0803392711

1/T

lnk

0.000702741 -1.43342586 0.2384904859

1/T

lnk

0.000678887 -0.41922267 0.6575577574

1/T

lnk

0.000656599 0.52838805 1.6961959206

1/T

lnk

0.000635728 1.415756516 4.119601833

t (min)
5
10
15
30
60
90

t (min)
5
10
15
30
60
90

t (min)
5
10
15
30
60
90

t (min)
5
10
15
30
60
90

t (min)
5
10
15
30
60
90

1.00000000

0.90000000

0.80000000

0.70000000

0.60000000

0.50000000

0.40000000

0.30000000

0.20000000

0.10000000

0.00000000
0

10

20

30

40

50

60

70

-4.2517 *(1/T)*10000

k*t

(k*T)0.5

1-R

6.97928E-005
0.0001395856
0.0002093784
0.0004187568
0.0008375137
0.0012562705

0.008354209
0.011814636
0.014469914
0.020463549
0.028939829
0.035443907

0.99168059
0.98825488
0.98563427
0.97974441
0.97147492
0.96517687

0.00831941
0.01174512
0.01436573
0.02025559
0.02852508
0.03482313

k*t

(k*T)0.5

1-R

0.0004073825
0.000814765
0.0012221475
0.002444295
0.0048885901
0.0073328851

0.020183719
0.028544089
0.034959227
0.049439812
0.069918453
0.085632267

0.98001861
0.97185944
0.96564479
0.95176244
0.93246986
0.91793172

0.01998139
0.02814056
0.03435521
0.04823756
0.06753014
0.08206828

k*t

(k*T)0.5

1-R

0.0020458562
0.0040917124
0.0061375686
0.0122751372
0.0245502744
0.0368254115

0.045231142
0.063966494
0.078342636
0.110793218
0.156685272
0.191899483

0.95577654
0.93803643
0.92464755
0.89512383
0.85497310
0.82538983

0.04422346
0.06196357
0.07535245
0.10487617
0.14502690
0.17461017

k*t

(k*T)0.5

1-R

0.009004097
0.0180081941
0.0270122911
0.0540245822
0.1080491644
0.1620737467

0.094889921
0.134194613
0.164354164
0.232431887
0.328708327
0.402583838

0.90947304
0.87441987
0.84844148
0.79260373
0.71985295
0.66859028

0.09052696
0.12558013
0.15155852
0.20739627
0.28014705
0.33140972

k*t

(k*T)0.5

1-R

0.0352736366
0.0705472732
0.1058209098
0.2116418196
0.4232836393
0.6349254589

0.18781277
0.265607367
0.32530126
0.460045454
0.65060252
0.7968221

0.82876986
0.76674012
0.72230972
0.63125495
0.52173133
0.45075916

0.17123014
0.23325988
0.27769028
0.36874505
0.47826867
0.54924084

k*t

(k*T)0.5

1-R

0.1246341831
0.2492683663
0.3739025494
0.7478050988
1.4956101977
2.2434152965

0.353035668
0.49926783
0.611475714
0.864757249
1.222951429
1.497803491

0.70255213
0.60697491
0.54254963
0.42115378
0.29436010
0.22362081

0.29744787
0.39302509
0.45745037
0.57884622
0.70563990
0.77637919

k*t

(k*T)0.5

1-R

0.4016963556
0.8033927112
1.2050890668
2.4101781337
4.8203562673
7.230534401

0.6337952
0.896321768
1.097765488
1.552474842
2.195530976
2.688965303

0.53057434
0.40806787
0.33361572
0.21172334
0.11129945
0.06795121

0.46942566
0.59193213
0.66638428
0.78827666
0.88870055
0.93204879

k*t

(k*T)0.5

1-R

1.1924524295
2.384904859
3.5773572885
7.154714577
14.309429154
21.464143731

1.091994702
1.544313718
1.891390306
2.674829822
3.782780611
4.632941153

0.33554651
0.21345831
0.15086192
0.06891856
0.02275932
0.00972611

0.66445349
0.78654169
0.84913808
0.93108144
0.97724068
0.99027389

k*t

(k*T)0.5

1-R

3.2877887871
6.5755775741
9.8633663612
19.726732722
39.453465445
59.180198167

1.813226072
2.564288902
3.140599682
4.441478664
6.281199364
7.692866707

0.16312703
0.07697390
0.04325685
0.01177851
0.00187116
0.00045607

0.83687297
0.92302610
0.95674315
0.98822149
0.99812884
0.99954393

k*t

(k*T)0.5

1-R

8.4809796028
16.961959206
25.442938809
50.885877617
101.77175523
152.65763285

2.912212149
4.118489918
5.044099405
7.133433789
10.08819881
12.35546975

0.05435535
0.01626906
0.00644726
0.00079797
0.00004157
0.00000431

0.94564465
0.98373094
0.99355274
0.99920203
0.99995843
0.99999569

k*t

(k*T)0.5

1-R

20.598009165
41.19601833
61.794027495
123.58805499
247.17610998
370.76416497

4.538502965
6.418412446
7.860917726
11.11701646
15.72183545
19.25523734

0.01068940
0.00163124
0.00038552
0.00001486
0.00000015
0.00000000

0.98931060
0.99836876
0.99961448
0.99998514
0.99999985
1.00000000

80
0
85
0
90
0
95
0
10
00
10
50
11
00

60

70

80

90

100

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