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Fluorene++ (C13H10++)
Electronic States :

Energy
(eV)

-500.80231

Description
S0

Multiplicity
1

Symmetry
-

Is Minimum
yes

Theory Level
DFT
B3LYP

Basis Sets
D95V**


Rotational Constants
(cm-1)

a
0.06760
b
0.02010
c
0.01554

Vibration Analisys

Harmonic: link
Anharmonic: None

Vibration Analysis Harmonic :

#

Frequency
(cm-1)

IR Intesity
(km/mol)

Symmetry

More...

# 1

69.97210

1.85690

B1

Infos

# 2

114.95460

0.00000

A2

Infos

# 3

206.91770

8.09300

B1

Infos

# 4

213.39480

0.00000

A2

Infos

# 5

219.41000

0.98340

A1

Infos

# 6

329.14180

0.50350

B1

Infos

# 7

391.16640

0.00000

A2

Infos

# 8

393.44240

18.89530

B1

Infos

# 9

419.70220

3.33640

A1

Infos

# 10

465.15520

0.00000

A2

Infos

# 11

491.66180

0.30900

B2

Infos

# 12

500.79040

1.15900

B2

Infos

# 13

592.68910

24.68250

B2

Infos

# 14

609.18520

7.51300

A1

Infos

# 15

620.32880

17.59550

B1

Infos

# 16

707.72110

0.00000

A2

Infos

# 17

720.05080

1.15140

A1

Infos

# 18

787.83850

16.28060

B2

Infos

# 19

788.59000

92.54150

B1

Infos

# 20

828.82790

0.99890

A1

Infos

# 21

839.55280

0.00000

A2

Infos

# 22

866.41240

4.11660

B1

Infos

# 23

904.78760

0.00000

A2

Infos

# 24

973.47090

146.96790

B2

Infos

# 25

975.39640

7.71360

B1

Infos

# 26

993.74570

23.43870

B2

Infos

# 27

995.06650

3.69890

A1

Infos

# 28

1007.27610

0.00000

A2

Infos

# 29

1011.11720

1.67350

B1

Infos

# 30

1038.31010

10.55320

B1

Infos

# 31

1039.34190

0.00000

A2

Infos

# 32

1105.71430

8.95440

B2

Infos

# 33

1115.69360

0.56020

A1

Infos

# 34

1163.92230

78.54870

A1

Infos

# 35

1168.84320

61.33190

B2

Infos

# 36

1181.89740

2.54060

B2

Infos

# 37

1184.35840

0.00000

A2

Infos

# 38

1205.92620

0.02530

A1

Infos

# 39

1243.70700

2.96570

B2

Infos

# 40

1272.44710

0.03050

A1

Infos

# 41

1344.68870

1.40500

B2

Infos

# 42

1376.81320

7.06760

B2

Infos

# 43

1381.43610

3.46210

A1

Infos

# 44

1406.52100

8.33410

A1

Infos

# 45

1430.37690

46.22390

A1

Infos

# 46

1436.92120

75.44120

B2

Infos

# 47

1455.36760

15.40900

B2

Infos

# 48

1479.73590

95.30710

A1

Infos

# 49

1543.65800

46.43690

A1

Infos

# 50

1553.75310

14.51460

B2

Infos

# 51

1586.89420

91.14770

A1

Infos

# 52

1648.21020

658.98880

B2

Infos

# 53

1693.95010

0.00600

A1

Infos

# 54

3059.13170

24.91050

A1

Infos

# 55

3101.06740

9.72650

B1

Infos

# 56

3206.31250

22.18340

B2

Infos

# 57

3206.36810

0.01760

A1

Infos

# 58

3223.33710

8.03560

B2

Infos

# 59

3224.84210

21.99670

B2

Infos

# 60

3224.92850

23.52240

A1

Infos

# 61

3227.02150

2.63700

A1

Infos

# 62

3236.01850

23.80130

B2

Infos

# 63

3238.07870

26.79800

A1

Infos