Geometry & MOs

Info

ID:	369355
PubChem CID:	127332424
Reduced:	O2N4C17H30 (1)
Stoich.:	A2B4C17D30 (1)
Weight, g/mol:	337.112999
ΔH_f, kcal/mol:	-75.1
Dipole, Da:	2.01
IP(EA), eV:	-9.52(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(hydroxymethyl)-N-(2-thiomorpholin-4-ylsulfonylethyl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1C(CCCO1)CNC(=O)N(C)CCN2C=CC=N2

DOS

IR

Vibrations