Geometry & MOs

Info

ID:	272688
PubChem CID:	103751742
Reduced:	BrClON2H10C13 (1)
Stoich.:	ABCD2E10F13 (1)
Weight, g/mol:	336.01095
ΔH_f, kcal/mol:	-3.87
Dipole, Da:	4.67
IP(EA), eV:	-9.1(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-(2,5-dimethoxyphenyl)pyridine-4-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations