Geometry & MOs

Info

ID:	367099
PubChem CID:	127323152
Reduced:	ON4C17H22 (1)
Stoich.:	AB4C17D22 (1)
Weight, g/mol:	322.236876
ΔH_f, kcal/mol:	15.45
Dipole, Da:	7.72
IP(EA), eV:	-8.84(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC(C1)N2CCN(CC2)CC(=O)NC3=CC=C(C=C3)C#N

DOS

IR

Vibrations