Geometry & MOs

Info

ID:	261529
PubChem CID:	103238629
Reduced:	NOC6H8 (2)
Stoich.:	ABC6D8 (2)
Weight, g/mol:	342.0743
ΔH_f, kcal/mol:	-51.23
Dipole, Da:	4.92
IP(EA), eV:	-9.41(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-bromo-4-fluoro-2-methylanilino)-N-cyclohexylacetamide

Drug info:

PubChemData

Smile

CC(C1=CC=CC=N1)NC/C=C(/C)\C(=O)O

DOS

IR

Vibrations