Extended Third Millennium Ideal Gas and Condensed Phase Thermochemical Database



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259.150

10.902



COClF Carbonic Chloride Fluoride

82.46120

-412.791

-410.054

±8.

52.397

276.926

11.904

†#

CCLF2 <~>

85.46021

-275.

-272.96

±25.

55.172

287.353

12.432



CCLF3 FC-13 <^>

104.45861

-710.02

-704.93

±1.0d

66.887

285.424

13.791



CLCN Cyanogen Chloride <&>

61.47014

134.200

133.510

±0.45d

44.960

236.144

10.669



CLCN+

61.46959

1333.33

1326.3

±0.95

45.016

242.867

10.813

#

CLNC

61.47014

316.59

315.0

±2.4

44.244

264.563

11.539

#

COCL Carbonyl Chloride <~>

63.46280

-16.000

-17.567

±10.

45.073

265.195

11.551



CCL2 <&>

82.91670

231.7

230.5

±1.7

51.028

266.112

11.728

#

CCL2+

82.91555

1226.42

1119.31

±8.

43.744

266.132

11.148

#

CCL2F

101.91450

-105.

-103.57

±20.

59.121

298.917

13.217



CCL2F2 FREON-12 <^~>

120.91291

-495.81

-491.63

±1.4d

72.477

300.908

14.881

#†

COCl2 liq Phosgen liq

98.9155

-242.62d

-255.32d

±0.28d










X

COCL2 PHOSGEN

98.9158

-219.5

-217.80

±0.28d

57.761

283.752

12.879



CCL3 <&>

118.3697

71.128

71.553

±2.5

63.500

303.100

14.400



CCL3F FC-11 <^>

137.36720

-290.67

-287.496

±1.12

78.071

309.785

16.064

#†

CCL3NO2 Chloropicrin

164.37434

-72.019

-65.324

±8.

104.209

355.281

21.145

#

CCL3O*

134.36820

-18.41

-18.12




90.154

332.520

18.768

#

CCL4 liquid c

153.82150

-128.22d

-108.81d

±0.49d

133.888

216.187







CCL4 <^>

153.82150

-95.6

-93.343

±2.5

82.890

309.467

17.159



CD <&>

14.0251

599.700

596.251




29.206

192.997

8.795

#

CD A 4Σ- (Excited state only)

14.02480

670.477

667.158




29.176

189.887

8.657

#

CDCLO Formyl-d-Chloride

65.47690

-190.678

-187.627




47.008

261.854

11.218

#

CDH3

17.04862

-78.45

-70.49




36.573

200.068

10.08

#

DCN

28.03154

128.220

128.407

±6.7

37.590

205.168

9.487

#

DN=C=O Isocyanic acid-D

44.03094

-128.415

-125.852

±8.

48.136

244.244

11.450

#

CDO Formyl – D Radical

30.0245

40.945

40.0




35.920

228.610




#

CD2

16.0389

382.59

382.063




36.262

204.294

10.150

#

CD2O Methanal-D2

32.0383

-114.893

-111.141




38.137

225.076

10.211

#

CD3

18.05301

138.69

141.841




41.807

207.024

10.756

#

CD3F MethylFluoride-D3

37.05141

-261.115

-253.236

±8.

41.909

229.852

10.440

#

O=CD-ND2 Formamide-D3

48.05915

-212.970

-203.549

±8.

60.306

290.056

13.162

#

CD3NO2

64.05885

-61.789

-48.423




63.166

291.669

13.556

#

CD4 RRHO

20.0671

-89.010

-81.166




40.536

199.014

10.348




CD4 ANHARMONIC

20.0671

-89.010

-81.161




40.582

199.023

10.343

#

CD4O CD3OD Methanol-d4

36.06651

-217.670

-207.07




49.478

249.248

11.932

#

CD5N CD3ND2 MethylAmine-d5

36.08795

-41.973

-27.405

±0.6

57.167

251.355

12.244

#

CF <~>

31.00910

246.932

243.333

±0.15d

30.056

213.034

9.065



CF+ Fluoromethyliumylidened

31.00855

1132.d

1122.66d

±0.55

29.642

201.509

8.697

#†

CF-

31.00965

197.9d

200.6d

±2.1d

31.858

199.919

8.880

#

FCN <&>

45.01584

8.141

8.132

±0.72

41.757

224.607

10.129

#†

FCN+c

45.01529

1300.66

1293.847

±1.1

42.557

232.192

10.417

#

FNC d

45.01584

301.1

299.19

±2.24

43.166

268.604

11.713

#

COF (FCO/CFO) <~>

47.00850

-176.305

-176.887

±0.5

38.880

248.992

10.388

#†

COF Fluoroisoformyl 1871-24-5

47.00850

-33.8

-39.2

±1.2










X

COF+ c CAS # 1871-25-6d

47.00795

1355.1d

1347.4d

±2.2d










X

FCO+ c 38264-00-5

47.00795

730.1d

724.2d

±1.5d

39.388

222.810

9.703

#

FCO-c,d

47.00905

-410.14

-405.352

±1.66

43.822

251.940

11.216

#

CF2 singlet <~>

50.00751

-193.36d

-193.84d

±0.57d

38.915

240.831

10.351

#†

CF2 Difluoromethylene triplet

50.00751

44.07d

43.35d

±0.57d

40.031

251.177

10.576

#

CF2+

50.00696

917.03

910.37

±1.6

38.541

246.731

10.342



CF2- c

50.00805

-216.096

-211.019

±0.73d

44.228

258.428

10.999

#

COF2 <~>

66.00721

-606.65

-603.57

±0.5

47.365

258.971

11.134

#†

COF2+

66.00636

656.82

653.379

±0.6

48.745

260.659

11.463

#

COF2-

66.00746

-611.6

-603.345

±2.77

54.339

265.677

12.161

#

FCOF trans Fluoro(fluorooxy) Methylene

66.00691

-40.2d

-38.7d

±2.0d

54.686

270.473

12.543

#

FCOF cis

66.00691

-136.7d

-135.5d

±2.1

56.177

276.481

12.919

#

CF3 <~>

69.00591

-467.4a

-464.6

±1.97

49.642

264.521

11.491



CF3+ Trifluoromethylium

69.00536

411.627

408.179

±0.7d

49.339

254.540

11.541



CF3-

69.00645

-646.7d

-638.57

±1.9d

56.614

263.934

12.358

#

CF3I <~>

195.91038

-590.5

-584.62

±0.68

70.941

307.633

15.008

#

CF3O Radical <~>

85.00531

-630.696

-625.69

±8.

64.550

283.750

13.622

#

CF3OO RADICAL

101.00471


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