WebMO Job Summary
3042: CH4O, Molecular Energy - Gaussian
Raw Output
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Calculated Quantities
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Overview
Quantity
Value
Route
#N HF/STO-3G SP Geom=Connectivity
Stoichiometry
CH
4
O
Symmetry
CS
Basis
STO-3G
RHF Energy
-113.539081802 Hartree
Dipole Moment
1.4763 Debye
Server
pauling.cs.moravian.edu (22156)
CPU time
1.4 sec
Rotational Constants
Constant
Frequency (GHz)
Frequency (cm
-1
)
a
123.6782203
4.12546136501
b
22.6048180
0.75401556633
c
21.7364330
0.72504936065
Partial Charges
Atom
Symbol
Charge
1
C
-0.083273
2
O
-0.258190
3
H
0.149127
4
H
0.074474
5
H
0.058931
6
H
0.058931
Quote
... SUBJECTS WHICH DISCLOSE THEIR FULL POWER, MEANING AND BEAUTY AS SOON AS THEY ARE PRESENTED TO THE MIND HAVE VERY LITTLE OF THOSE QUALITIES TO DISCLOSE. -- CHARLES DUTTON (1882)