Geometry & MOs

Info

ID:	31012
PubChem CID:	854094
Reduced:	ClO3H17C20 (1)
Stoich.:	AB3C17D20 (1)
Weight, g/mol:	346.120509
ΔH_f, kcal/mol:	-69.48
Dipole, Da:	4.33
IP(EA), eV:	-8.99(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-methoxyphenyl)methoxy]-4-methylbenzo[c]chromen-6-one

Drug info:

PubChemData

Smile

CC(=CCOC1=C(C=C2C(=CC(=O)OC2=C1)C3=CC=CC=C3)Cl)C

DOS

IR

Vibrations