Geometry & MOs

Info

ID:	364944
PubChem CID:	127316594
Reduced:	OSN6C16H26 (1)
Stoich.:	ABC6D16E26 (1)
Weight, g/mol:	355.189592
ΔH_f, kcal/mol:	27.2
Dipole, Da:	4.59
IP(EA), eV:	-8.97(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(4-cyclobutylpiperazin-1-yl)-1-oxopropan-2-yl]-5-methylisoindole-1,3-dione

Drug info:

PubChemData

Smile

C1CCC(C1)N2C(=NN=N2)SCC(=O)N3CCN(CC3)C4CCC4

DOS

IR

Vibrations