Geometry & MOs

Info

ID:	290083
PubChem CID:	104407689
Reduced:	SN3O3C10H17 (1)
Stoich.:	AB3C3D10E17 (1)
Weight, g/mol:	292.135782
ΔH_f, kcal/mol:	-129.21
Dipole, Da:	5.3
IP(EA), eV:	-8.76(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]pyridine-2-carbothioamide

Drug info:

PubChemData

Smile

CC(C(=O)N1CCOCC1)NC(=O)CC(=S)N

DOS

IR

Vibrations