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)
-692.03603
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03932 b
(cm-1)
0.00852 c
(cm-1)
0.00700
Dipole Moments
mu_x(Debye)
0.12919 mu_y
(Debye)
-0.56125 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.18500
Diff mu Y
(Debye)
0.24100
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.00103
0.00799
0.00000
2
0.00657
0.00461
0.00000
3
0.01027
0.01060
0.00000
4
-0.00344
0.00658
0.00000
5
-0.02719
-0.01401
0.00000
6
0.01178
-0.02295
0.00000
7
0.00336
0.00716
0.00000
8
-0.00208
0.00197
0.00000
9
0.04775
-0.07901
0.00000
10
-0.07012
-0.03336
0.00000
11
0.00189
-0.00461
0.00000
12
0.00104
-0.00258
0.00000
13
0.11998
0.05369
0.00000
14
-0.07624
0.11065
0.00000
15
-0.00551
-0.00967
0.00000
16
-0.01014
-0.00316
0.00000
17
0.00318
0.01726
0.00000
18
0.00523
-0.00504
0.00000
19
0.00749
0.03984
0.00000
20
0.01813
0.05335
0.00000
21
-0.02448
-0.35735
0.00000
22
-0.14504
-0.27382
0.00000
23
-0.00264
0.00616
0.00000
24
0.22101
-0.03469
0.00000
25
-0.27944
0.07349
0.00000
26
-0.00129
-0.00289
0.00000
27
0.00731
-0.02593
0.00000
28
-0.01631
-0.01820
0.00000
29
0.00650
0.01988
0.00000
30
0.02628
-0.02911
0.00000