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)
0.00600
Diff mu Y
(Debye)
0.18800
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.05413
-0.02173
0.00000
2
-0.04302
0.00909
0.00000
3
-0.06726
-0.00090
0.00000
4
-0.06362
-0.00082
0.00000
5
-0.02657
-0.02934
0.00000
6
-0.01798
-0.00339
0.00000
7
-0.03727
0.01874
0.00000
8
-0.04654
-0.02547
0.00000
9
0.01529
-0.07287
0.00000
10
0.03935
0.01083
0.00000
11
-0.00800
-0.00798
0.00000
12
-0.01709
-0.02432
0.00000
13
0.06997
-0.06276
0.00000
14
0.08128
-0.02558
0.00000
15
-0.01459
0.07797
0.00000
16
0.04152
0.09473
0.00000
17
0.07129
0.05880
0.00000
18
0.05113
0.00380
0.00000
19
-0.05939
-0.03751
0.00000
20
-0.03812
0.02992
0.00000
21
0.00296
-0.12193
0.00000
22
0.05258
0.05895
0.00000
23
-0.05421
-0.05072
0.00000
24
0.09398
-0.08760
0.00000
25
0.11501
-0.01688
0.00000
26
-0.00629
-0.03670
0.00000
27
-0.04267
0.11227
0.00000
28
0.05405
0.13132
0.00000
29
0.11141
0.06726
0.00000
30
0.08324
-0.03420
0.00000