Geometry & MOs

Info

ID:	8428
PubChem CID:	77654
Reduced:	BrN2O3C15H15 (1)
Stoich.:	AB2C3D15E15 (1)
Weight, g/mol:	350.0266
ΔH_f, kcal/mol:	-76.91
Dipole, Da:	3.79
IP(EA), eV:	-8.82(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-[2-(dimethylamino)phenyl]-3,5-dihydroxybenzamide

Drug info:

PubChemData

Smile

CN(C)C1=CC=CC=C1NC(=O)C2=CC(=C(C(=C2)O)Br)O

DOS

IR

Vibrations