Geometry & MOs

Info

ID:	57672
PubChem CID:	22432060
Reduced:	ClN5H18C20 (1)
Stoich.:	AB5C18D20 (1)
Weight, g/mol:	315.133139
ΔH_f, kcal/mol:	105.4
Dipole, Da:	2.73
IP(EA), eV:	-8.14(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(2-oxopyrrolidin-1-yl)propyl]-5-pyridin-3-yl-1,3,4-oxadiazole-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC2=NC3=C(C=C(C=C3)Cl)N=C2N4C(=CC(=N4)C)C

DOS

IR

Vibrations