Geometry & MOs

Info

ID:	19703
PubChem CID:	570778
Reduced:	C31H38 (1)
Stoich.:	A31B38 (1)
Weight, g/mol:	410.297351
ΔH_f, kcal/mol:	19.08
Dipole, Da:	1.29
IP(EA), eV:	-8.68(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-4-[2-methyl-7,9-bis(4-methylphenyl)non-1-en-5-yl]benzene

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CCC(CC(CCC(=C)C)C2=CC=C(C=C2)C)C3=CC=C(C=C3)C

DOS

IR

Vibrations