Geometry & MOs

Info

ID:	356741
PubChem CID:	127292222
Reduced:	OSN5C20H27 (1)
Stoich.:	ABC5D20E27 (1)
Weight, g/mol:	280.189926
ΔH_f, kcal/mol:	36.24
Dipole, Da:	5.06
IP(EA), eV:	-9.06(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C1=CC=CC=C1)C2=NN=C(S2)NC(=O)NC3CCN(CC3)C4CC4

DOS

IR

Vibrations