Geometry & MOs

Info

ID:	359104
PubChem CID:	127297349
Reduced:	SN2O2C12H22 (1)
Stoich.:	AB2C2D12E22 (1)
Weight, g/mol:	359.184506
ΔH_f, kcal/mol:	-84.31
Dipole, Da:	3.28
IP(EA), eV:	-8.44(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-N-(cyclobutylmethyl)acetamide

Drug info:

PubChemData

Smile

CS(=O)(=O)N1CCCN(CC1)C2CCCC=C2

DOS

IR

Vibrations