Geometry & MOs

Info

ID:	252287
PubChem CID:	103110278
Reduced:	ON5C12H19 (1)
Stoich.:	AB5C12D19 (1)
Weight, g/mol:	272.132491
ΔH_f, kcal/mol:	6.42
Dipole, Da:	3.18
IP(EA), eV:	-8.95(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-amino-2-methylphenyl)methyl]-2-fluoro-4-methylbenzamide

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NC1=C(C(=NN1C)C)C#N

DOS

IR

Vibrations