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)
0.27800
Diff mu Y
(Debye)
-0.11700
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.00007
-0.00023
0.00000
2
-0.00014
-0.00027
0.00000
3
0.00894
0.00344
0.00000
4
-0.06094
0.02324
0.00000
5
0.00187
0.00219
0.00000
6
0.00050
0.00018
0.00000
7
-0.00163
0.00066
0.00000
8
0.00028
0.00001
0.00000
9
-0.00066
0.00174
0.00000
10
0.01035
-0.00388
0.00000
11
0.00781
-0.00291
0.00000
12
-0.00051
0.00125
0.00000
13
0.00053
0.00022
0.00000
14
-0.00250
0.00091
0.00000
15
0.00044
0.00017
0.00000
16
0.00144
0.00164
0.00000
17
-0.04635
0.01768
0.00000
18
0.00670
0.00259
0.00000
19
0.68702
-0.27090
0.00000
20
-0.11712
0.04102
0.00000
21
0.00392
-0.02399
0.00000
22
-0.00272
-0.00211
0.00000
23
0.01771
-0.00571
0.00000
24
-0.07194
-0.04777
0.00000
25
-0.09565
-0.06357
0.00000
26
0.02756
-0.00887
0.00000
27
-0.00565
-0.00438
0.00000
28
0.00286
-0.01749
0.00000
29
-0.08830
0.03091
0.00000
30
0.52263
-0.20608
0.00000