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)
-692.28642
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03906 b
(cm-1)
0.00844 c
(cm-1)
0.00694
Dipole Moments
mu_x(Debye)
-0.13629 mu_y
(Debye)
0.70909 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-0.78000
Diff mu Y
(Debye)
-0.61100
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.04925
0.02917
0.00000
2
-0.06426
0.02168
0.00000
3
0.06399
-0.05145
0.00000
4
0.09463
-0.02997
0.00000
5
0.04786
-0.00161
0.00000
6
0.04450
-0.02463
0.00000
7
-0.08694
0.07680
0.00000
8
-0.05472
-0.00315
0.00000
9
-0.02327
0.01016
0.00000
10
-0.01828
0.01258
0.00000
11
0.01548
-0.06343
0.00000
12
0.01726
0.01136
0.00000
13
-0.00166
0.00411
0.00000
14
-0.01254
-0.00804
0.00000
15
-0.00071
0.01597
0.00000
16
0.03206
0.00573
0.00000
17
0.00077
0.01763
0.00000
18
0.01935
-0.00943
0.00000
19
-0.09525
-0.15097
0.00000
20
-0.00922
0.21455
0.00000
21
-0.07981
-0.18702
0.00000
22
0.02696
0.17044
0.00000
23
-0.07052
-0.06010
0.00000
24
0.02939
-0.02834
0.00000
25
0.04354
0.00700
0.00000
26
-0.04322
0.06770
0.00000
27
0.19459
-0.20180
0.00000
28
-0.02599
-0.17809
0.00000
29
-0.10678
-0.00384
0.00000
30
-0.15266
0.19013
0.00000