Geometry & MOs

Info

ID:	84065
PubChem CID:	49863969
Reduced:	O3N11C30H43 (1)
Stoich.:	A3B11C30D43 (1)
Weight, g/mol:	309.100108
ΔH_f, kcal/mol:	-62.23
Dipole, Da:	5.27
IP(EA), eV:	-8.67(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methoxy-4-oxo-2-phenylchromen-6-yl)acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CNC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)[C@H](CCCN=C(N)N)N

DOS

IR

Vibrations