Charge: 2
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+2
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)
-0.28700
Diff mu Y
(Debye)
-0.44500
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.07321
-0.01907
0.00000
2
-0.04587
-0.02411
0.00000
3
-0.04818
0.02141
0.00000
4
0.04179
-0.00211
0.00000
5
0.02778
-0.02530
0.00000
6
-0.00864
-0.01463
0.00000
7
0.02663
0.06589
0.00000
8
0.09544
0.00534
0.00000
9
0.05093
-0.00861
0.00000
10
0.02466
0.00166
0.00000
11
-0.02389
0.01045
0.00000
12
-0.10839
-0.03271
0.00000
13
-0.02795
-0.00975
0.00000
14
-0.01027
0.05224
0.00000
15
0.07772
0.04985
0.00000
16
-0.04846
-0.00052
0.00000
17
0.01586
-0.07664
0.00000
18
0.03472
0.01004
0.00000
19
-0.10559
-0.13373
0.00000
20
-0.06747
-0.10140
0.00000
21
0.07041
0.05770
0.00000
22
0.01650
-0.02316
0.00000
23
0.14317
0.16233
0.00000
24
-0.02575
-0.00964
0.00000
25
-0.00280
0.05267
0.00000
26
-0.19443
0.06383
0.00000
27
0.16986
-0.05282
0.00000
28
-0.05021
-0.01687
0.00000
29
0.02635
-0.07367
0.00000
30
0.01199
0.03382
0.00000