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)
0.70300
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.05650
2
0.00000
0.00000
0.07832
3
0.00000
0.00000
-0.03770
4
0.00000
0.00000
-0.03569
5
0.00000
0.00000
-0.11932
6
0.00000
0.00000
-0.12047
7
0.00000
0.00000
0.00799
8
0.00000
0.00000
-0.01633
9
0.00000
0.00000
0.06348
10
0.00000
0.00000
0.05622
11
0.00000
0.00000
0.04624
12
0.00000
0.00000
-0.00584
13
0.00000
0.00000
-0.02765
14
0.00000
0.00000
-0.01710
15
0.00000
0.00000
-0.02054
16
0.00000
0.00000
0.03620
17
0.00000
0.00000
-0.03094
18
0.00000
0.00000
0.00324
19
0.00000
0.00000
0.28583
20
0.00000
0.00000
0.32960
21
0.00000
0.00000
0.26991
22
0.00000
0.00000
0.23857
23
0.00000
0.00000
0.01684
24
0.00000
0.00000
-0.01865
25
0.00000
0.00000
0.01394
26
0.00000
0.00000
-0.01847
27
0.00000
0.00000
-0.09329
28
0.00000
0.00000
0.08754
29
0.00000
0.00000
-0.09037
30
0.00000
0.00000
-0.02845