Charge: 2
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+2
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)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.28100
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00861
2
0.00000
0.00000
-0.00662
3
0.00000
0.00000
0.00423
4
0.00000
0.00000
-0.02141
5
0.00000
0.00000
-0.00427
6
0.00000
0.00000
-0.02829
7
0.00000
0.00000
-0.03173
8
0.00000
0.00000
0.02306
9
0.00000
0.00000
0.00750
10
0.00000
0.00000
0.03201
11
0.00000
0.00000
0.09079
12
0.00000
0.00000
0.01256
13
0.00000
0.00000
0.03390
14
0.00000
0.00000
0.01526
15
0.00000
0.00000
-0.01715
16
0.00000
0.00000
-0.06305
17
0.00000
0.00000
-0.00980
18
0.00000
0.00000
-0.07531
19
0.00000
0.00000
0.02037
20
0.00000
0.00000
0.11866
21
0.00000
0.00000
-0.16075
22
0.00000
0.00000
-0.15341
23
0.00000
0.00000
-0.11025
24
0.00000
0.00000
-0.19535
25
0.00000
0.00000
-0.25328
26
0.00000
0.00000
-0.24994
27
0.00000
0.00000
0.35930
28
0.00000
0.00000
0.30022
29
0.00000
0.00000
0.43430
30
0.00000
0.00000
0.24408