Geometry & MOs

Info

ID:	225
PubChem CID:	2361
Reduced:	O2H12C19 (1)
Stoich.:	A2B12C19 (1)
Weight, g/mol:	272.08373
ΔH_f, kcal/mol:	7.07
Dipole, Da:	4.37
IP(EA), eV:	-9.08(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-phenylbenzo[f]chromen-1-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=CC4=CC=CC=C43

DOS

IR

Vibrations