Geometry & MOs

Info

ID:	352478
PubChem CID:	127283566
Reduced:	O2N5C21H29 (1)
Stoich.:	A2B5C21D29 (1)
Weight, g/mol:	331.200825
ΔH_f, kcal/mol:	-26.44
Dipole, Da:	6.65
IP(EA), eV:	-9.21(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-4-[3-(1,2,4-triazol-1-yl)piperidine-1-carbonyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)CC2=CC=C(C=C2)C(=O)N3CCCC(C3)N4C=NC=N4

DOS

IR

Vibrations