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)
-692.28444
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03906 b
(cm-1)
0.00854 c
(cm-1)
0.00701
Dipole Moments
mu_x(Debye)
0.02298 mu_y
(Debye)
-0.00245 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-0.18700
Diff mu Y
(Debye)
-0.64900
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.05796
-0.01418
0.00000
2
-0.00448
0.00102
0.00000
3
-0.00100
-0.00198
0.00000
4
-0.00033
0.00095
0.00000
5
0.00045
0.00155
0.00000
6
-0.00052
0.00056
0.00000
7
0.00157
-0.00045
0.00000
8
-0.02165
0.00837
0.00000
9
0.01030
-0.00308
0.00000
10
0.00703
-0.00121
0.00000
11
0.00053
0.00040
0.00000
12
-0.01640
-0.01792
0.00000
13
0.00299
0.00408
0.00000
14
0.00236
-0.01304
0.00000
15
-0.01938
-0.01749
0.00000
16
-0.01839
0.00781
0.00000
17
0.00607
-0.02176
0.00000
18
-0.01396
-0.01106
0.00000
19
-0.66965
0.17377
0.00000
20
0.05072
-0.01469
0.00000
21
-0.11922
0.03117
0.00000
22
-0.07349
0.01945
0.00000
23
0.24626
-0.07769
0.00000
24
-0.04049
-0.04246
0.00000
25
-0.03511
0.14621
0.00000
26
0.19341
0.18633
0.00000
27
0.22079
0.18884
0.00000
28
0.21364
-0.07265
0.00000
29
-0.05444
0.25313
0.00000
30
0.14925
0.13046
0.00000