Charge: -1
Inchi:1S/C20H12/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-12H/q-1
Electronic States
Energy
(eV)
-767.79023
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.02870 b
(cm-1)
0.00846 c
(cm-1)
0.00654
Dipole Moments
mu_x(Debye)
-0.17956 mu_y
(Debye)
-0.00356 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.30900
Diff mu Y
(Debye)
-0.48700
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.03711
-0.03496
0.00000
2
-0.05126
-0.04881
0.00000
3
-0.02332
0.04540
0.00000
4
-0.02223
-0.00622
0.00000
5
-0.00993
-0.01409
0.00000
6
-0.01734
-0.02549
0.00000
7
0.02187
0.02673
0.00000
8
0.06041
-0.03550
0.00000
9
0.01982
-0.00785
0.00000
10
0.03593
0.03433
0.00000
11
-0.00898
0.08453
0.00000
12
-0.02094
-0.00562
0.00000
13
-0.00566
-0.01897
0.00000
14
0.03948
0.04380
0.00000
15
-0.01242
0.01372
0.00000
16
-0.00392
0.00694
0.00000
17
-0.00544
0.05747
0.00000
18
-0.10701
-0.08969
0.00000
19
0.03590
-0.03912
0.00000
20
0.10293
-0.00057
0.00000
21
-0.00983
0.07395
0.00000
22
0.04108
-0.11321
0.00000
23
-0.00136
-0.08006
0.00000
24
-0.00261
0.08482
0.00000
25
-0.02223
-0.00424
0.00000
26
-0.01556
-0.04774
0.00000
27
0.06188
0.02494
0.00000
28
-0.08126
-0.00656
0.00000
29
0.12752
-0.02571
0.00000
30
-0.15427
-0.05710
0.00000
31
0.02578
0.21015
0.00000
32
0.14061
0.10714
0.00000