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October 10, 2024
CH4
CH4
ID
1
Molecular Formula
CH4
Elemental Composition %
C: 20%
H: 80%
O: 0%
N: 0%
Weight
16.0428
Programa de Cálculo
G16
SMILES
C
Nivel de Teoría
B3LYP/6-31G(2df, p)
InChI
InChI=1S/CH4/h1H4
Calculation Keys
# B3LYP/6-31G(2df,p) scf=(maxcycle=9999) nosymm output=wfx
InChIKey
VNWKTOKETHGBQD-UHFFFAOYSA-N