Geometry & MOs

Info

ID:	443829
PubChem CID:	135260123
Reduced:	O3C19H20 (1)
Stoich.:	A3B19C20 (1)
Weight, g/mol:	312.172545
ΔH_f, kcal/mol:	-59.84
Dipole, Da:	1.67
IP(EA), eV:	-8.6(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2-dimethoxy-4-[(E)-4-(4-methoxyphenyl)-3-methylbut-1-enyl]benzene

Drug info:

PubChemData

Smile

CC(CC1=CC=C(C=C1)OC)/C=C/C2=CC3=C(C=C2)OCO3

DOS

IR

Vibrations