Geometry & MOs

Info

ID:	347581
PubChem CID:	127272436
Reduced:	SO2N3C16H19 (1)
Stoich.:	AB2C3D16E19 (1)
Weight, g/mol:	372.183127
ΔH_f, kcal/mol:	-31.09
Dipole, Da:	2.74
IP(EA), eV:	-8.72(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,1-dioxothiolan-3-yl)carbamoyl]-2-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

C1CCCC2=C(CC1)N=C(S2)NC(=O)COC3=CN=CC=C3

DOS

IR

Vibrations