Geometry & MOs

Info

ID:	36204
PubChem CID:	7980890
Reduced:	N2O3H20C22 (1)
Stoich.:	A2B3C20D22 (1)
Weight, g/mol:	399.147058
ΔH_f, kcal/mol:	-49.88
Dipole, Da:	1.81
IP(EA), eV:	-8.95(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(7,8-dimethyl-2-oxochromen-4-yl)methoxy]-N-phenylbenzamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1=CC=CC=C1)OC2=CC=CC=C2C(=O)NC3=CC=CC=C3

DOS

IR

Vibrations