Geometry & MOs

Info

ID:	277362
PubChem CID:	103828087
Reduced:	Cl2N2O2H10C13 (1)
Stoich.:	A2B2C2D10E13 (1)
Weight, g/mol:	306.00039
ΔH_f, kcal/mol:	-45.19
Dipole, Da:	4.12
IP(EA), eV:	-8.91(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(N=C2)Cl)Cl)O

DOS

IR

Vibrations