Geometry & MOs

Info

ID:	364839
PubChem CID:	127316280
Reduced:	SN3O3C20H33 (1)
Stoich.:	AB3C3D20E33 (1)
Weight, g/mol:	242.108899
ΔH_f, kcal/mol:	-175.13
Dipole, Da:	2.66
IP(EA), eV:	-8.62(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-5-oxo-N-(thian-4-ylmethyl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1CCC2(CC1)C(=O)N(C(=O)N2)CC(=O)NCC3CCSCC3

DOS

IR

Vibrations