Geometry & MOs

Info

ID:	246731
PubChem CID:	103064748
Reduced:	OSN3C15H23 (1)
Stoich.:	ABC3D15E23 (1)
Weight, g/mol:	279.140533
ΔH_f, kcal/mol:	-43.86
Dipole, Da:	3.73
IP(EA), eV:	-8.62(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-6-(ethylamino)-N-(thiolan-3-yl)pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCCC1=NC(=CC(=C1)C(=O)NC2CCSC2)NCC

DOS

IR

Vibrations