Geometry & MOs

Info

ID:	368749
PubChem CID:	127330000
Reduced:	OSN5C13H21 (1)
Stoich.:	ABC5D13E21 (1)
Weight, g/mol:	382.240248
ΔH_f, kcal/mol:	-6.38
Dipole, Da:	3.08
IP(EA), eV:	-8.61(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methylsulfanylcyclohexyl)-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CSC1CCCC(C1)NC(=O)N2CCN3C=NN=C3C2

DOS

IR

Vibrations