Geometry & MOs

Info

ID:	302457
PubChem CID:	124361812
Reduced:	N3O4C15H21 (1)
Stoich.:	A3B4C15D21 (1)
Weight, g/mol:	505.132587
ΔH_f, kcal/mol:	-172.95
Dipole, Da:	4.22
IP(EA), eV:	-8.4(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-butyl-6-chloro-2-oxochromen-7-yl) (2R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations