Geometry & MOs

Info

ID:	269779
PubChem CID:	103619011
Reduced:	BrON3C11H16 (1)
Stoich.:	ABC3D11E16 (1)
Weight, g/mol:	269.11757
ΔH_f, kcal/mol:	-21.29
Dipole, Da:	4.03
IP(EA), eV:	-9.55(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-(2-fluoro-5-nitrophenyl)hexanamide

Drug info:

PubChemData

Smile

CCCCC(C(=O)NC1=NC=C(C=C1)Br)N

DOS

IR

Vibrations