Geometry & MOs

Info

ID:	386539
PubChem CID:	134982072
Reduced:	O5C15H16 (1)
Stoich.:	A5B15C16 (1)
Weight, g/mol:	302.070972
ΔH_f, kcal/mol:	-169.26
Dipole, Da:	2.86
IP(EA), eV:	-8.95(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-chlorophenyl)-5,6-dimethoxy-2,3-dihydroinden-1-one

Drug info:

PubChemData

Smile

CC(C)C1=C(C(C2=CC3=C(C=C21)OCO3)O)C(=O)OC

DOS

IR

Vibrations