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)
-0.08800
Diff mu Y
(Debye)
0.20500
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00769
-0.00167
0.00000
2
-0.00007
0.00005
0.00000
3
-0.00006
-0.00021
0.00000
4
-0.00001
-0.00009
0.00000
5
-0.00004
0.00022
0.00000
6
-0.00003
0.00005
0.00000
7
-0.00092
0.00083
0.00000
8
-0.00002
0.00002
0.00000
9
0.00041
-0.00019
0.00000
10
-0.00009
-0.00003
0.00000
11
-0.00084
0.00097
0.00000
12
-0.00038
-0.00044
0.00000
13
0.00020
0.00026
0.00000
14
-0.00012
0.00059
0.00000
15
0.02060
0.01768
0.00000
16
0.02770
-0.00793
0.00000
17
0.01612
-0.07107
0.00000
18
-0.02016
-0.01210
0.00000
19
-0.08938
0.02182
0.00000
20
0.00083
-0.00025
0.00000
21
-0.00488
0.00100
0.00000
22
0.00066
-0.00014
0.00000
23
0.00060
-0.00030
0.00000
24
-0.00258
-0.00252
0.00000
25
0.00164
-0.00639
0.00000
26
0.00588
0.00433
0.00000
27
-0.23476
-0.18841
0.00000
28
-0.29196
0.09848
0.00000
29
-0.16736
0.78909
0.00000
30
0.18641
0.15295
0.00000