Geometry & MOs

Info

ID:	367029
PubChem CID:	127322961
Reduced:	SO3N5C18H25 (1)
Stoich.:	AB3C5D18E25 (1)
Weight, g/mol:	379.225977
ΔH_f, kcal/mol:	-71.16
Dipole, Da:	2.6
IP(EA), eV:	-8.9(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-acetyl-N-cyclopentyl-N-[(2-methylquinolin-4-yl)methyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)N1CCOCC1)N2CCN(CC2)C(=O)CC3=CN4C=CSC4=N3

DOS

IR

Vibrations