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)
-385.33887
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09476 b
(cm-1)
0.04104 c
(cm-1)
0.02864
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.36944
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
-0.08900
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.05775
0.00000
2
0.00000
-0.01557
0.03064
3
0.00000
-0.01557
-0.03064
4
0.00000
-0.06202
0.02228
5
0.00000
-0.06202
-0.02228
6
0.00000
0.06301
0.03270
7
0.00000
0.06301
-0.03270
8
0.00000
-0.04995
-0.02005
9
0.00000
-0.04995
0.02005
10
0.00000
0.02968
0.00000
11
0.00000
0.15254
0.00000
12
0.00000
0.06922
-0.13849
13
0.00000
0.06922
0.13849
14
0.00000
-0.03749
0.14316
15
0.00000
-0.03749
-0.14316
16
0.00000
-0.14096
0.27483
17
0.00000
-0.14096
-0.27483
18
0.00000
0.56184
0.00000