Geometry & MOs

Info

ID:	359083
PubChem CID:	127297328
Reduced:	N3O3C16H27 (1)
Stoich.:	A3B3C16D27 (1)
Weight, g/mol:	376.156912
ΔH_f, kcal/mol:	-136.04
Dipole, Da:	4.31
IP(EA), eV:	-9.02(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]-N-(cyclobutylmethyl)acetamide

Drug info:

PubChemData

Smile

C1CC(C1)CNC(=O)CN2CCN(CC2)C(=O)C3CCCO3

DOS

IR

Vibrations