Geometry & MOs

Info

ID:	155818
PubChem CID:	56367668
Reduced:	BrFN2O2C16H20 (1)
Stoich.:	ABC2D2E16F20 (1)
Weight, g/mol:	395.202048
ΔH_f, kcal/mol:	-131.44
Dipole, Da:	3.58
IP(EA), eV:	-9.59(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[3-(butanoylamino)piperidin-1-yl]-4-oxobutyl]-2,4-difluorobenzamide

Drug info:

PubChemData

Smile

CCCC(=O)NC1CCCN(C1)C(=O)C2=CC(=CC(=C2)Br)F

DOS

IR

Vibrations