Geometry & MOs

Info

ID:	174016
PubChem CID:	75712619
Reduced:	FO2N3C27H38 (1)
Stoich.:	AB2C3D27E38 (1)
Weight, g/mol:	426.268257
ΔH_f, kcal/mol:	-121.66
Dipole, Da:	7.9
IP(EA), eV:	-8.54(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(tert-butylamino)-1-(4-methylphenyl)-2-oxoethyl]-4-fluoro-N-hexylbenzamide

Drug info:

PubChemData

Smile

CCCCCCN(C(C1=CC=C(C=C1)N(C)C)C(=O)NCCCC)C(=O)C2=CC=C(C=C2)F

DOS

IR

Vibrations