Charge: -1
Inchi:1S/C18H12/c1-2-7-15-12-18-16(11-14(15)6-1)10-9-13-5-3-4-8-17(13)18/h1-12H/q-1
Electronic States
Energy
(eV)
-691.62999
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03982 b
(cm-1)
0.00842 c
(cm-1)
0.00695
Dipole Moments
mu_x(Debye)
-0.27351 mu_y
(Debye)
0.67795 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-1.71800
Diff mu Y
(Debye)
-2.41500
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.00052
-0.02761
0.00000
2
-0.04198
-0.07037
0.00000
3
-0.02428
0.05074
0.00000
4
0.03679
-0.00304
0.00000
5
-0.01743
-0.02640
0.00000
6
0.04176
0.10672
0.00000
7
0.01727
-0.05018
0.00000
8
-0.02416
0.03874
0.00000
9
0.00107
0.03532
0.00000
10
-0.01753
-0.08977
0.00000
11
-0.03846
0.05100
0.00000
12
0.06974
-0.07476
0.00000
13
0.02567
-0.03742
0.00000
14
-0.00486
0.03944
0.00000
15
-0.00720
0.00314
0.00000
16
-0.01155
0.02053
0.00000
17
0.07598
-0.01442
0.00000
18
-0.05408
0.01600
0.00000
19
0.02043
0.06484
0.00000
20
0.01236
0.17157
0.00000
21
-0.01931
-0.04468
0.00000
22
0.06272
0.19542
0.00000
23
-0.04426
-0.01106
0.00000
24
-0.07600
0.06498
0.00000
25
0.00769
0.05012
0.00000
26
-0.14040
0.16226
0.00000
27
0.02700
-0.04551
0.00000
28
-0.05315
-0.09199
0.00000
29
-0.11554
-0.06273
0.00000
30
0.00588
-0.06798
0.00000