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)
-0.20300
Diff mu Y
(Debye)
-1.48700
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.00173
-0.02711
0.00000
2
-0.00173
-0.02712
0.00000
3
0.00228
-0.00637
0.00000
4
-0.01389
-0.00132
0.00000
5
-0.00859
0.01416
0.00000
6
0.02522
0.00299
0.00000
7
-0.02718
0.07840
0.00000
8
-0.07694
-0.04256
0.00000
9
0.04107
-0.07574
0.00000
10
0.05015
0.02335
0.00000
11
0.05015
0.02336
0.00000
12
0.04108
-0.07576
0.00000
13
-0.07695
-0.04256
0.00000
14
-0.02719
0.07842
0.00000
15
0.02523
0.00298
0.00000
16
-0.00858
0.01416
0.00000
17
-0.01390
-0.00132
0.00000
18
0.00228
-0.00637
0.00000
19
-0.02935
-0.03662
0.00000
20
0.11671
0.19174
0.00000
21
0.15196
-0.06764
0.00000
22
-0.13154
0.01111
0.00000
23
0.03324
0.27150
0.00000
24
-0.02671
0.03705
0.00000
25
-0.02673
0.03707
0.00000
26
0.03325
0.27155
0.00000
27
-0.13156
0.01111
0.00000
28
0.15201
-0.06765
0.00000
29
0.11672
0.19178
0.00000
30
-0.02935
-0.03662
0.00000