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)
-0.15000
Diff mu Y
(Debye)
0.08300
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.04087
-0.06460
0.00000
2
-0.00025
0.08711
0.00000
3
-0.07746
-0.00905
0.00000
4
-0.09280
0.05059
0.00000
5
0.05308
-0.03320
0.00000
6
0.06191
0.00262
0.00000
7
0.02402
-0.00969
0.00000
8
-0.08210
0.05249
0.00000
9
0.02156
-0.00560
0.00000
10
0.00428
-0.01428
0.00000
11
0.03189
0.02882
0.00000
12
0.02473
0.05597
0.00000
13
-0.04575
-0.00772
0.00000
14
-0.04485
0.00688
0.00000
15
0.03443
-0.04827
0.00000
16
0.05114
-0.06334
0.00000
17
0.03581
-0.03775
0.00000
18
0.04539
0.01790
0.00000
19
-0.06110
-0.14691
0.00000
20
0.02334
0.18086
0.00000
21
0.03741
0.05685
0.00000
22
-0.01349
-0.08043
0.00000
23
-0.10190
-0.01132
0.00000
24
-0.05747
0.00470
0.00000
25
-0.04936
0.00525
0.00000
26
0.04699
0.03002
0.00000
27
0.04829
-0.06452
0.00000
28
0.05345
-0.05981
0.00000
29
-0.01229
-0.04854
0.00000
30
0.03666
0.02793
0.00000