Geometry & MOs

Info

ID:	20420
PubChem CID:	583843
Reduced:	C7H11 (2)
Stoich.:	A7B11 (2)
Weight, g/mol:	190.172151
ΔH_f, kcal/mol:	-29.97
Dipole, Da:	1.06
IP(EA), eV:	-8.67(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2,4-trimethyl-3-(3-methylbutyl)benzene

Drug info:

PubChemData

Smile

CC1=C(C(=C(C=C1)C)CCC(C)C)C

DOS

IR

Vibrations