Geometry & MOs

Info

ID:	257198
PubChem CID:	103144345
Reduced:	N2O2C17H20 (1)
Stoich.:	A2B2C17D20 (1)
Weight, g/mol:	336.02735
ΔH_f, kcal/mol:	-58.8
Dipole, Da:	5.3
IP(EA), eV:	-7.87(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-amino-2,5-dimethylphenyl)-4-bromo-2-fluorobenzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1NC(=O)CC2=CC=C(C=C2)OC)C)N

DOS

IR

Vibrations