Geometry & MOs

Info

ID:	60782
PubChem CID:	26702155
Reduced:	BrFNO2H13C15 (1)
Stoich.:	ABCD2E13F15 (1)
Weight, g/mol:	393.05757
ΔH_f, kcal/mol:	-83.25
Dipole, Da:	3.88
IP(EA), eV:	-8.79(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-(2,5-diethoxyphenyl)-4-methoxybenzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)C2=CC(=C(C=C2)OC)Br)F

DOS

IR

Vibrations