Geometry & MOs

Info

ID:	175748
PubChem CID:	75943065
Reduced:	BrN4O4H15C18 (1)
Stoich.:	AB4C4D15E18 (1)
Weight, g/mol:	393.0688
ΔH_f, kcal/mol:	-88.05
Dipole, Da:	9.0
IP(EA), eV:	-8.93(-1.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-acetamido-5-bromophenyl)-1-(cyclopropylmethyl)-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(=O)NC1=C(C=C(C=C1)Br)NC(=O)CN2C(=O)C3C=CC=CC3=NC2=O

DOS

IR

Vibrations