Geometry & MOs

Info

ID:	353683
PubChem CID:	127285260
Reduced:	O2N3C16H27 (1)
Stoich.:	A2B3C16D27 (1)
Weight, g/mol:	394.167477
ΔH_f, kcal/mol:	-112.07
Dipole, Da:	3.98
IP(EA), eV:	-9.04(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methyl-3-oxopiperazin-1-yl)-N-(4-piperidin-1-ylsulfonylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1C(=O)NCCN1CC(=O)N2CCCC3C2CCCC3

DOS

IR

Vibrations