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)
-0.03200
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.04565
2
0.00000
0.00000
0.02335
3
0.00000
0.00000
0.04320
4
0.00000
0.00000
-0.03606
5
0.00000
0.00000
-0.03235
6
0.00000
0.00000
0.04440
7
0.00000
0.00000
-0.03474
8
0.00000
0.00000
0.02137
9
0.00000
0.00000
0.06989
10
0.00000
0.00000
-0.07394
11
0.00000
0.00000
0.01070
12
0.00000
0.00000
0.00695
13
0.00000
0.00000
0.04933
14
0.00000
0.00000
-0.05500
15
0.00000
0.00000
0.01093
16
0.00000
0.00000
-0.00357
17
0.00000
0.00000
0.00699
18
0.00000
0.00000
-0.00323
19
0.00000
0.00000
0.27998
20
0.00000
0.00000
-0.18312
21
0.00000
0.00000
-0.43392
22
0.00000
0.00000
0.44282
23
0.00000
0.00000
-0.03786
24
0.00000
0.00000
-0.26140
25
0.00000
0.00000
0.31044
26
0.00000
0.00000
-0.10857
27
0.00000
0.00000
0.00728
28
0.00000
0.00000
-0.02116
29
0.00000
0.00000
-0.01326
30
0.00000
0.00000
-0.01166