Geometry & MOs

Info

ID:	274084
PubChem CID:	103806924
Reduced:	BrOSN2C10H15 (1)
Stoich.:	ABCD2E10F15 (1)
Weight, g/mol:	281.012267
ΔH_f, kcal/mol:	-13.53
Dipole, Da:	3.37
IP(EA), eV:	-8.97(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-(6-chloropyridazin-3-yl)-2-methylbenzamide

Drug info:

PubChemData

Smile

CC(CNC)CNC(=O)C1=CSC(=C1)Br

DOS

IR

Vibrations