Geometry & MOs

Info

ID:	365311
PubChem CID:	127317695
Reduced:	ON2C8H13 (2)
Stoich.:	AB2C8D13 (2)
Weight, g/mol:	399.252192
ΔH_f, kcal/mol:	-21.75
Dipole, Da:	0.52
IP(EA), eV:	-8.41(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-cyclobutylpiperazin-1-yl)-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]acetamide

Drug info:

PubChemData

Smile

C1CC(C1)N2CCN(CC2)CC3=NOC(=N3)C4CCOCC4

DOS

IR

Vibrations