Geometry & MOs

Info

ID:	202786
PubChem CID:	79726383
Reduced:	BrN2O3H13C14 (1)
Stoich.:	AB2C3D13E14 (1)
Weight, g/mol:	259.095691
ΔH_f, kcal/mol:	-70.66
Dipole, Da:	6.74
IP(EA), eV:	-8.67(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-aminopyridin-4-yl)-3-hydroxy-4-methoxybenzamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C(=O)NC2=C(C=C(C=C2)Br)N)O

DOS

IR

Vibrations