Geometry & MOs

Info

ID:	14576
PubChem CID:	415245
Reduced:	NO3H17C22 (1)
Stoich.:	AB3C17D22 (1)
Weight, g/mol:	343.120843
ΔH_f, kcal/mol:	-34.69
Dipole, Da:	2.81
IP(EA), eV:	-9.36(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-oxo-2-phenyl-2,3-dihydrochromen-3-yl)benzamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2C(C(=O)C3=CC=CC=C3O2)NC(=O)C4=CC=CC=C4

DOS

IR

Vibrations