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)
1.26400
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.01563
2
0.00000
0.00000
0.01100
3
0.00000
0.00000
0.00818
4
0.00000
0.00000
-0.07221
5
0.00000
0.00000
0.04625
6
0.00000
0.00000
0.01257
7
0.00000
0.00000
0.01845
8
0.00000
0.00000
0.03954
9
0.00000
0.00000
-0.04180
10
0.00000
0.00000
-0.03441
11
0.00000
0.00000
0.06574
12
0.00000
0.00000
-0.01255
13
0.00000
0.00000
-0.02300
14
0.00000
0.00000
-0.03314
15
0.00000
0.00000
-0.04545
16
0.00000
0.00000
-0.04544
17
0.00000
0.00000
-0.02489
18
0.00000
0.00000
-0.03896
19
0.00000
0.00000
-0.18198
20
0.00000
0.00000
0.04743
21
0.00000
0.00000
0.19378
22
0.00000
0.00000
0.21982
23
0.00000
0.00000
-0.00946
24
0.00000
0.00000
0.30281
25
0.00000
0.00000
0.28816
26
0.00000
0.00000
-0.18442
27
0.00000
0.00000
0.30041
28
0.00000
0.00000
0.36060
29
0.00000
0.00000
0.34131
30
0.00000
0.00000
0.16095