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)
-0.48100
Diff mu Y
(Debye)
0.10100
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00290
-0.00066
0.00000
2
-0.02463
0.00679
0.00000
3
0.00028
-0.00034
0.00000
4
-0.00014
-0.00079
0.00000
5
0.00083
0.00130
0.00000
6
0.00049
0.00005
0.00000
7
-0.00006
-0.00006
0.00000
8
-0.00845
0.00221
0.00000
9
-0.05066
0.01420
0.00000
10
-0.02853
0.00805
0.00000
11
-0.00035
0.00049
0.00000
12
0.00954
0.00920
0.00000
13
0.02488
0.02321
0.00000
14
0.00664
-0.02564
0.00000
15
-0.00105
-0.00084
0.00000
16
0.00236
-0.00082
0.00000
17
-0.00072
0.00486
0.00000
18
-0.00750
-0.00658
0.00000
19
-0.03332
0.00648
0.00000
20
0.28452
-0.07621
0.00000
21
0.59190
-0.16593
0.00000
22
0.33591
-0.09486
0.00000
23
0.10166
-0.03034
0.00000
24
-0.29341
-0.29143
0.00000
25
-0.07627
0.31037
0.00000
26
-0.11145
-0.10694
0.00000
27
0.01258
0.01055
0.00000
28
-0.02858
0.00943
0.00000
29
0.01192
-0.05907
0.00000
30
0.08774
0.07597
0.00000