Geometry & MOs

Info

ID:	355116
PubChem CID:	127288048
Reduced:	SO2N3C12H17 (1)
Stoich.:	AB2C3D12E17 (1)
Weight, g/mol:	222.111676
ΔH_f, kcal/mol:	-75.84
Dipole, Da:	2.34
IP(EA), eV:	-9.27(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(2-ethylpyrazol-3-yl)-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CCC1=NC(=CS1)CCNC(=O)[C@H]2CCC(=O)N2

DOS

IR

Vibrations