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January 28, 2026
C4H10O
Datos Químicos de C4H10O
ID
136
Molecular Formula
C4H10O
Elemental Composition %
C: 26.6666666666667%
H: 66.6666666666667%
O: 6.66666666666667%
N: 0%
Weight
74.1224
Programa de Cálculo
G16
SMILES
CCOCC
Nivel de Teoría
B3LYP/6-31G(2df, p)
InChI
InChI=1S/C4H10O/c1-3-5-4-2/h3-4H2,1-2H3
Calculation Keys
# B3LYP/6-31G(2df,p) scf=(maxcycle=9999) nosymm output=wfx
InChIKey
RTZKZFJDLAIYFH-UHFFFAOYSA-N