Geometry & MOs

Info

ID:	38340
PubChem CID:	8030908
Reduced:	O3N5C23H27 (1)
Stoich.:	A3B5C23D27 (1)
Weight, g/mol:	405.0404
ΔH_f, kcal/mol:	-57.1
Dipole, Da:	5.24
IP(EA), eV:	-8.7(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(6-chloro-2-oxochromen-4-yl)-1-benzofuran-3-yl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C[C@@H](C(=O)NC1=CC(=CC=C1)OC)NC(=O)N2CCN3C2=NC4=CC=CC=C43

DOS

IR

Vibrations