Geometry & MOs

Info

ID:	238241
PubChem CID:	92729827
Reduced:	N3O3C21H31 (1)
Stoich.:	A3B3C21D31 (1)
Weight, g/mol:	387.252192
ΔH_f, kcal/mol:	-152.0
Dipole, Da:	7.54
IP(EA), eV:	-9.19(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(3-methylbutyl)-1-[4-(pentanoylamino)benzoyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)CCNC(=O)[C@H]1CCCN1C(=O)C2=CC=C(C=C2)NC(=O)C(C)C

DOS

IR

Vibrations