Charge: -1
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-1
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)
0.02900
Diff mu Y
(Debye)
-0.06600
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00094
-0.00005
0.00000
2
-0.00662
0.00143
0.00000
3
0.00047
-0.00017
0.00000
4
0.00143
0.00131
0.00000
5
0.00001
-0.00010
0.00000
6
0.00019
0.00037
0.00000
7
-0.00031
0.00011
0.00000
8
-0.05680
0.01424
0.00000
9
0.00014
0.00016
0.00000
10
0.00440
-0.00130
0.00000
11
-0.00204
0.00085
0.00000
12
0.04451
0.03690
0.00000
13
-0.00011
-0.00030
0.00000
14
-0.00042
0.00093
0.00000
15
-0.00106
-0.00083
0.00000
16
0.00087
-0.00020
0.00000
17
-0.00023
0.00216
0.00000
18
-0.00774
-0.00650
0.00000
19
-0.01019
0.00238
0.00000
20
0.07482
-0.02074
0.00000
21
-0.00106
0.00023
0.00000
22
-0.05009
0.01358
0.00000
23
0.64371
-0.18613
0.00000
24
0.00205
0.00199
0.00000
25
0.00320
-0.01207
0.00000
26
-0.49343
-0.44016
0.00000
27
0.01245
0.00979
0.00000
28
-0.00923
0.00315
0.00000
29
0.00576
-0.02789
0.00000
30
0.08822
0.07213
0.00000