Geometry & MOs

Info

ID:	426593
PubChem CID:	135151211
Reduced:	BrClNOC5H5 (1)
Stoich.:	ABCDE5F5 (1)
Weight, g/mol:	549.151385
ΔH_f, kcal/mol:	-57.97
Dipole, Da:	6.8
IP(EA), eV:	-10.03(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-fluorophenyl)-2-[6-(6-piperazin-1-ylpyridin-3-yl)indazol-2-yl]-N-(1,3-thiazol-2-yl)acetamide;hydrochloride

Drug info:

PubChemData

Smile

C1=CNC(=O)C=C1Br.Cl

DOS

IR

Vibrations