Geometry & MOs

Info

ID:	357250
PubChem CID:	127293783
Reduced:	NOC5H7 (4)
Stoich.:	ABC5D7 (4)
Weight, g/mol:	380.202382
ΔH_f, kcal/mol:	-128.26
Dipole, Da:	2.3
IP(EA), eV:	-8.38(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[3-(4-ethylpiperazin-1-yl)pyrrolidin-1-yl]-2-oxoethyl]-2,4-difluorobenzamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)C2CCN(C2)C(=O)CNC(=O)C3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations