Charge: -1
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-3,5-8H,4H2/q-1
Electronic States
Energy
(eV)
-384.61791
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09639 b
(cm-1)
0.04048 c
(cm-1)
0.02851
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.27338
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.20600
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
-0.00242
0.00000
2
0.00000
0.02736
-0.01976
3
0.00000
0.02736
0.01976
4
0.00000
-0.04732
0.00870
5
0.00000
-0.04733
-0.00870
6
0.00000
0.00145
0.00120
7
0.00000
0.00145
-0.00120
8
0.00000
0.00098
0.00052
9
0.00000
0.00098
-0.00052
10
0.00000
0.00013
0.00000
11
0.00000
0.00135
-0.00001
12
0.00000
-0.30503
-0.24280
13
0.00000
-0.30507
0.24284
14
0.00000
0.53812
-0.11457
15
0.00000
0.53820
0.11458
16
0.00000
-0.01126
-0.00253
17
0.00000
-0.01126
0.00253
18
0.00000
-0.00003
0.00000