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)
-692.28444
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)
0.02800
Diff mu Y
(Debye)
0.00900
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.04626
-0.01796
0.00000
2
0.02541
-0.04707
0.00000
3
0.07067
0.01475
0.00000
4
-0.04798
0.04674
0.00000
5
0.08793
-0.02653
0.00000
6
-0.08461
0.02907
0.00000
7
-0.06136
-0.02482
0.00000
8
0.00747
-0.02034
0.00000
9
-0.03565
0.05281
0.00000
10
0.06099
0.02998
0.00000
11
0.03692
0.03938
0.00000
12
-0.01083
0.00555
0.00000
13
0.06566
-0.05843
0.00000
14
-0.09177
-0.02119
0.00000
15
0.02598
0.02786
0.00000
16
-0.03637
-0.06549
0.00000
17
0.05679
0.03145
0.00000
18
-0.02207
-0.02090
0.00000
19
-0.02095
0.08442
0.00000
20
0.05870
0.07643
0.00000
21
-0.06937
-0.05475
0.00000
22
0.03337
-0.08557
0.00000
23
0.02786
0.04586
0.00000
24
-0.05881
0.06239
0.00000
25
0.09808
0.02167
0.00000
26
-0.01396
0.01214
0.00000
27
0.03049
0.02827
0.00000
28
0.02155
0.11360
0.00000
29
-0.08414
0.00469
0.00000
30
-0.03370
-0.00997
0.00000