Geometry & MOs

Info

ID:	252283
PubChem CID:	103110260
Reduced:	FON3C13H16 (1)
Stoich.:	ABC3D13E16 (1)
Weight, g/mol:	276.220164
ΔH_f, kcal/mol:	-49.05
Dipole, Da:	7.6
IP(EA), eV:	-9.21(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-amino-2-methylphenyl)methyl]nonanamide

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NC1=C(C(=CC=C1)F)C#N

DOS

IR

Vibrations