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)
-0.29000
Diff mu Y
(Debye)
0.65800
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.00428
0.00106
0.00000
2
0.01577
-0.01330
0.00000
3
-0.01315
0.03962
0.00000
4
-0.00825
0.00424
0.00000
5
-0.00281
-0.00848
0.00000
6
0.00208
-0.01428
0.00000
7
0.03330
0.03654
0.00000
8
0.00262
0.01214
0.00000
9
0.00313
-0.02915
0.00000
10
-0.03418
-0.00731
0.00000
11
-0.00265
-0.02035
0.00000
12
-0.00045
-0.00121
0.00000
13
0.03675
0.02606
0.00000
14
-0.01504
0.03102
0.00000
15
-0.01707
-0.09741
0.00000
16
-0.10514
-0.01699
0.00000
17
0.03849
0.13598
0.00000
18
0.04499
-0.02174
0.00000
19
-0.02606
-0.09114
0.00000
20
0.01884
-0.00787
0.00000
21
-0.01831
-0.12038
0.00000
22
-0.05408
-0.06798
0.00000
23
0.00556
0.02243
0.00000
24
0.07033
-0.00211
0.00000
25
-0.04554
0.02739
0.00000
26
-0.02303
0.02280
0.00000
27
0.13874
-0.30088
0.00000
28
-0.15265
-0.12121
0.00000
29
0.18472
0.17867
0.00000
30
0.20949
-0.21163
0.00000