Geometry & MOs

Info

ID:	4729
PubChem CID:	11931
Reduced:	CH (14)
Stoich.:	AB (14)
Weight, g/mol:	182.10955
ΔH_f, kcal/mol:	26.95
Dipole, Da:	1.06
IP(EA), eV:	-8.96(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-(3-methylphenyl)benzene

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2=CC=CC(=C2)C

DOS

IR

Vibrations