Geometry & MOs

Info

ID:	175255
PubChem CID:	75873976
Reduced:	O2N3C21H23 (1)
Stoich.:	A2B3C21D23 (1)
Weight, g/mol:	415.9558
ΔH_f, kcal/mol:	-44.32
Dipole, Da:	4.94
IP(EA), eV:	-8.68(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(cyclopropanecarbonyl)-N-(2,5-dibromophenyl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CCN1CC(CC1=O)C(=O)NC2=CC=CC=C2N3CCC4=CC=CC=C43

DOS

IR

Vibrations