Charge: 1
Inchi:1S/C18H12/c1-3-7-15-13(5-1)9-11-18-16-8-4-2-6-14(16)10-12-17(15)18/h1-12H/q+1
Electronic States
Energy
(eV)
-691.62195
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2h
Symmetry Elements
E
C2(z)
sigmah(xy)
i
Rotational Constants
(cm-1)
0.04269 b
(cm-1)
0.00858 c
(cm-1)
0.00715
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00500
Diff mu Y
(Debye)
0.00200
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00041
-0.00010
0.00000
2
-0.00040
0.00010
0.00000
3
0.00699
0.00513
0.00000
4
0.00249
-0.00147
0.00000
5
-0.00010
-0.00023
0.00000
6
-0.00077
-0.00049
0.00000
7
0.02464
-0.00605
0.00000
8
-0.04041
-0.03122
0.00000
9
0.00056
0.01220
0.00000
10
-0.00897
0.00259
0.00000
11
0.00867
-0.00250
0.00000
12
-0.00055
-0.01188
0.00000
13
0.03930
0.03037
0.00000
14
-0.02395
0.00588
0.00000
15
0.00076
0.00048
0.00000
16
0.00011
0.00023
0.00000
17
-0.00261
0.00152
0.00000
18
-0.00720
-0.00527
0.00000
19
-0.02851
0.01192
0.00000
20
0.09925
-0.03584
0.00000
21
0.01967
-0.13954
0.00000
22
0.45739
0.36129
0.00000
23
-0.27902
0.09033
0.00000
24
0.08089
0.05608
0.00000
25
-0.07857
-0.05446
0.00000
26
0.27118
-0.08779
0.00000
27
-0.44483
-0.35137
0.00000
28
-0.01916
0.13587
0.00000
29
-0.09591
0.03463
0.00000
30
0.02978
-0.01241
0.00000