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January 28, 2026
C9H10
Datos Químicos de C9H10
ID
39607
Molecular Formula
C9H10
Elemental Composition %
C: 47.3684210526316%
H: 52.6315789473684%
O: 0%
N: 0%
Weight
118.178
Programa de Cálculo
G16
SMILES
C1/C=CC=C/C=CC=C1
Nivel de Teoría
B3LYP/6-31G(2df, p)
InChI
InChI=1S/C9H10/c1-2-4-6-8-9-7-5-3-1/h1-8H,9H2
Calculation Keys
# B3LYP/6-31G(2df,p) scf=(maxcycle=9999) nosymm output=wfx
InChIKey
GORPVKZVZYAFSO-UHFFFAOYSA-N