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)
-692.28444
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03906 b
(cm-1)
0.00854 c
(cm-1)
0.00701
Dipole Moments
mu_x(Debye)
0.02298 mu_y
(Debye)
-0.00245 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.09500
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.11896
2
0.00000
0.00000
-0.03927
3
0.00000
0.00000
0.08166
4
0.00000
0.00000
0.05266
5
0.00000
0.00000
-0.02291
6
0.00000
0.00000
-0.08146
7
0.00000
0.00000
-0.01770
8
0.00000
0.00000
0.06136
9
0.00000
0.00000
-0.08273
10
0.00000
0.00000
-0.03438
11
0.00000
0.00000
-0.06797
12
0.00000
0.00000
-0.03435
13
0.00000
0.00000
-0.00039
14
0.00000
0.00000
0.08235
15
0.00000
0.00000
-0.07380
16
0.00000
0.00000
0.01184
17
0.00000
0.00000
0.06958
18
0.00000
0.00000
-0.04255
19
0.00000
0.00000
0.20304
20
0.00000
0.00000
-0.05917
21
0.00000
0.00000
-0.13809
22
0.00000
0.00000
-0.02688
23
0.00000
0.00000
0.10268
24
0.00000
0.00000
0.00764
25
0.00000
0.00000
0.19789
26
0.00000
0.00000
-0.05840
27
0.00000
0.00000
-0.13948
28
0.00000
0.00000
0.03077
29
0.00000
0.00000
0.16365
30
0.00000
0.00000
-0.05639