Geometry & MOs

Info

ID:	221159
PubChem CID:	85257071
Reduced:	OC6H8 (3)
Stoich.:	AB6C8 (3)
Weight, g/mol:	288.091707
ΔH_f, kcal/mol:	-123.09
Dipole, Da:	2.8
IP(EA), eV:	-9.2(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2-chloro-3-methylphenyl)ethenyl]-2,3-dimethoxybenzene

Drug info:

PubChemData

Smile

C1CCC(CC1)OC2CC(C=C(O2)CO)C3=CC=CC=C3

DOS

IR

Vibrations