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)
-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)
1.13200
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.11694
2
0.00000
0.00000
-0.06639
3
0.00000
0.00000
0.05890
4
0.00000
0.00000
0.03332
5
0.00000
0.00000
0.06163
6
0.00000
0.00000
0.01359
7
0.00000
0.00000
-0.04763
8
0.00000
0.00000
-0.02055
9
0.00000
0.00000
-0.01847
10
0.00000
0.00000
0.01537
11
0.00000
0.00000
0.03490
12
0.00000
0.00000
-0.02966
13
0.00000
0.00000
-0.03201
14
0.00000
0.00000
-0.01363
15
0.00000
0.00000
0.03171
16
0.00000
0.00000
-0.01306
17
0.00000
0.00000
-0.00663
18
0.00000
0.00000
-0.01083
19
0.00000
0.00000
0.55760
20
0.00000
0.00000
0.37289
21
0.00000
0.00000
0.02975
22
0.00000
0.00000
-0.10712
23
0.00000
0.00000
0.09494
24
0.00000
0.00000
0.24284
25
0.00000
0.00000
0.10435
26
0.00000
0.00000
0.15818
27
0.00000
0.00000
-0.07391
28
0.00000
0.00000
0.02757
29
0.00000
0.00000
0.09077
30
0.00000
0.00000
0.00722