Charge: 1
Inchi:1S/C18H12/c1-3-7-15-13(5-1)9-11-18-16-8-4-2-6-14(16)10-12-17(15)18/h1-12H/q+1
Electronic States
Energy
(eV)
-691.62195
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2h
Symmetry Elements
E
C2(z)
sigmah(xy)
i
Rotational Constants
(cm-1)
0.04269 b
(cm-1)
0.00858 c
(cm-1)
0.00715
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.77500
Diff mu Y
(Debye)
-1.38900
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.03548
0.00875
0.00000
2
-0.03547
0.00874
0.00000
3
0.04023
-0.00619
0.00000
4
-0.03845
-0.04999
0.00000
5
0.00791
0.05405
0.00000
6
0.05611
0.01857
0.00000
7
-0.05649
-0.03717
0.00000
8
0.07399
-0.03033
0.00000
9
-0.07942
0.01451
0.00000
10
0.01841
-0.02858
0.00000
11
0.01840
-0.02861
0.00000
12
-0.07942
0.01453
0.00000
13
0.07400
-0.03036
0.00000
14
-0.05648
-0.03712
0.00000
15
0.05611
0.01854
0.00000
16
0.00790
0.05408
0.00000
17
-0.03845
-0.05000
0.00000
18
0.04024
-0.00620
0.00000
19
0.03880
0.15693
0.00000
20
0.06182
0.07640
0.00000
21
0.13515
0.05369
0.00000
22
-0.06431
0.15740
0.00000
23
-0.00204
0.14711
0.00000
24
-0.01252
0.07994
0.00000
25
-0.01250
0.07992
0.00000
26
-0.00207
0.14703
0.00000
27
-0.06435
0.15742
0.00000
28
0.13513
0.05371
0.00000
29
0.06185
0.07645
0.00000
30
0.03882
0.15697
0.00000