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)
-692.28642
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03906 b
(cm-1)
0.00844 c
(cm-1)
0.00694
Dipole Moments
mu_x(Debye)
-0.13629 mu_y
(Debye)
0.70909 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.04500
Diff mu Y
(Debye)
-0.35000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.01432
0.00084
0.00000
2
-0.02176
0.01155
0.00000
3
-0.02918
0.05263
0.00000
4
0.06434
-0.00631
0.00000
5
-0.09657
-0.01230
0.00000
6
0.07110
-0.05795
0.00000
7
-0.03546
-0.06270
0.00000
8
-0.01760
-0.02030
0.00000
9
0.01814
0.06995
0.00000
10
0.02508
0.08860
0.00000
11
0.06562
0.06085
0.00000
12
-0.03111
0.01111
0.00000
13
0.06061
-0.06489
0.00000
14
-0.07432
-0.02562
0.00000
15
0.02430
-0.03633
0.00000
16
-0.00102
0.04415
0.00000
17
-0.03809
0.00115
0.00000
18
0.02511
-0.03652
0.00000
19
-0.03006
-0.15309
0.00000
20
-0.03681
-0.05721
0.00000
21
0.01213
0.05209
0.00000
22
-0.01703
-0.06198
0.00000
23
-0.04755
-0.11752
0.00000
24
-0.05668
0.05724
0.00000
25
-0.00252
-0.00754
0.00000
26
-0.10201
0.08922
0.00000
27
-0.02327
0.01375
0.00000
28
-0.01700
-0.00079
0.00000
29
0.00897
0.01113
0.00000
30
0.03176
-0.03885
0.00000