Geometry & MOs

Info

ID:	30944
PubChem CID:	853859
Reduced:	ON2H16C17 (1)
Stoich.:	AB2C16D17 (1)
Weight, g/mol:	321.01645
ΔH_f, kcal/mol:	21.04
Dipole, Da:	4.74
IP(EA), eV:	-9.37(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-2,6-dimethylphenyl)-4-fluorobenzamide

Drug info:

PubChemData

Smile

C1CN[C@@]2(C3=CC=CC=C3C(=O)N2C1)C4=CC=CC=C4

DOS

IR

Vibrations