Geometry & MOs

Info

ID:	208886
PubChem CID:	80600019
Reduced:	OSN3C10H21 (1)
Stoich.:	ABC3D10E21 (1)
Weight, g/mol:	242.145285
ΔH_f, kcal/mol:	-27.56
Dipole, Da:	3.15
IP(EA), eV:	-8.64(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(ethylamino)-1-(thian-2-ylmethyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

CCC(C(=NO)N)NCC1CCCCS1

DOS

IR

Vibrations