Geometry & MOs

Info

ID:	277679
PubChem CID:	103830332
Reduced:	BrNO3C12H14 (1)
Stoich.:	ABC3D12E14 (1)
Weight, g/mol:	319.02079
ΔH_f, kcal/mol:	-109.52
Dipole, Da:	4.76
IP(EA), eV:	-9.39(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-(2,4-dimethylphenyl)-3-hydroxybenzamide

Drug info:

PubChemData

Smile

C1CC(OC1)CNC(=O)C2=CC(=C(C=C2)Br)O

DOS

IR

Vibrations