Geometry & MOs

Info

ID:	252100
PubChem CID:	103109128
Reduced:	SO2N4C12H20 (1)
Stoich.:	AB2C4D12E20 (1)
Weight, g/mol:	241.179027
ΔH_f, kcal/mol:	-70.59
Dipole, Da:	1.73
IP(EA), eV:	-9.29(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NC(=O)C1=CSC(=N1)C(C)N

DOS

IR

Vibrations