Geometry & MOs

Info

ID:	64599
PubChem CID:	29203189
Reduced:	N3O3C19H25 (1)
Stoich.:	A3B3C19D25 (1)
Weight, g/mol:	250.142976
ΔH_f, kcal/mol:	-131.04
Dipole, Da:	7.95
IP(EA), eV:	-8.79(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)CCCNC(=O)CC2=CC=C(C=C2)N3CCCC3=O

DOS

IR

Vibrations