Geometry & MOs

Info

ID:	276989
PubChem CID:	103826166
Reduced:	FON3C10H14 (1)
Stoich.:	ABC3D10E14 (1)
Weight, g/mol:	271.171834
ΔH_f, kcal/mol:	-62.51
Dipole, Da:	4.16
IP(EA), eV:	-8.82(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-N-(2-thiomorpholin-4-ylethyl)pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(C(C1)NC2=NC=C(C=N2)F)CO

DOS

IR

Vibrations