Geometry & MOs

Info

ID:	365265
PubChem CID:	127317610
Reduced:	N3O4C18H23 (1)
Stoich.:	A3B4C18D23 (1)
Weight, g/mol:	315.194677
ΔH_f, kcal/mol:	-118.48
Dipole, Da:	3.77
IP(EA), eV:	-8.69(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-cyclobutylpiperazin-1-yl)-2-oxoethyl]-2-methylbenzamide

Drug info:

PubChemData

Smile

C1CC(C1)N2CCN(CC2)C(=O)CNC(=O)C3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations