Geometry & MOs

Info

ID:	322916
PubChem CID:	126671572
Reduced:	ClON2H9C10 (1)
Stoich.:	ABC2D9E10 (1)
Weight, g/mol:	193.121512
ΔH_f, kcal/mol:	32.22
Dipole, Da:	3.27
IP(EA), eV:	-9.82(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-1-(1-methylpyrazol-3-yl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

CCC1=NOC(=N1)C2=CC=CC=C2Cl

DOS

IR

Vibrations