Geometry & MOs

Info

ID:	365271
PubChem CID:	127317616
Reduced:	ON4C12H18 (1)
Stoich.:	AB4C12D18 (1)
Weight, g/mol:	337.160183
ΔH_f, kcal/mol:	-0.89
Dipole, Da:	2.26
IP(EA), eV:	-8.81(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC(C1)N2CCN(CC2)C(=O)C3=CN=CN3

DOS

IR

Vibrations