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)
-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)
0.31800
Diff mu Y
(Debye)
0.04300
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.00274
0.00070
0.00000
2
-0.00045
-0.00008
0.00000
3
0.00004
-0.00007
0.00000
4
0.00017
0.00015
0.00000
5
0.00098
0.00132
0.00000
6
0.00052
-0.00034
0.00000
7
-0.00010
0.00011
0.00000
8
-0.00027
-0.00004
0.00000
9
-0.03087
0.00969
0.00000
10
-0.01009
0.00156
0.00000
11
-0.00003
-0.00004
0.00000
12
-0.00024
-0.00017
0.00000
13
-0.04850
-0.04980
0.00000
14
-0.00507
0.03281
0.00000
15
0.00151
0.00121
0.00000
16
0.00165
-0.00060
0.00000
17
-0.00030
0.00070
0.00000
18
0.00020
0.00008
0.00000
19
0.03117
-0.00861
0.00000
20
0.00393
-0.00074
0.00000
21
0.34725
-0.08982
0.00000
22
0.10985
-0.02889
0.00000
23
0.00233
-0.00068
0.00000
24
0.56023
0.54990
0.00000
25
0.09227
-0.37326
0.00000
26
0.00248
0.00224
0.00000
27
-0.01690
-0.01341
0.00000
28
-0.01831
0.00644
0.00000
29
0.00191
-0.00854
0.00000
30
-0.00169
-0.00138
0.00000