Geometry & MOs

Info

ID:	356698
PubChem CID:	127292179
Reduced:	SO2N4C18H28 (1)
Stoich.:	AB2C4D18E28 (1)
Weight, g/mol:	268.189926
ΔH_f, kcal/mol:	-74.71
Dipole, Da:	8.29
IP(EA), eV:	-9.22(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-ethylpiperidin-4-yl)-2-methyl-3-oxopiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(CNC(=O)N2CCNC(=O)C2C)C3=CC=CS3

DOS

IR

Vibrations