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)
0.19800
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.05990
2
0.00000
0.00000
-0.04129
3
0.00000
0.00000
-0.05816
4
0.00000
0.00000
0.02905
5
0.00000
0.00000
0.01278
6
0.00000
0.00000
-0.00887
7
0.00000
0.00000
0.06020
8
0.00000
0.00000
-0.00252
9
0.00000
0.00000
-0.07702
10
0.00000
0.00000
0.06982
11
0.00000
0.00000
-0.01963
12
0.00000
0.00000
-0.01110
13
0.00000
0.00000
-0.01199
14
0.00000
0.00000
0.00929
15
0.00000
0.00000
-0.06182
16
0.00000
0.00000
-0.01901
17
0.00000
0.00000
0.01747
18
0.00000
0.00000
0.03529
19
0.00000
0.00000
-0.27502
20
0.00000
0.00000
0.17375
21
0.00000
0.00000
0.41440
22
0.00000
0.00000
-0.34390
23
0.00000
0.00000
-0.00259
24
0.00000
0.00000
0.17802
25
0.00000
0.00000
-0.16348
26
0.00000
0.00000
0.10169
27
0.00000
0.00000
0.29805
28
0.00000
0.00000
0.14198
29
0.00000
0.00000
-0.10950
30
0.00000
0.00000
-0.20367