Geometry & MOs

Info

ID:	187318
PubChem CID:	77558236
Reduced:	FSN4O8C20H21 (1)
Stoich.:	ABC4D8E20F21 (1)
Weight, g/mol:	447.149574
ΔH_f, kcal/mol:	-336.63
Dipole, Da:	4.45
IP(EA), eV:	-9.6(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3-methylpyrazolidin-4-yl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyridine;hydrochloride

Drug info:

PubChemData

Smile

CC(=O)NS(=O)(=O)C1=CC=CN(C1=O)C2=CC(=C(C=C2)NC(=O)C3CC(CN3C(=O)O)OC)F

DOS

IR

Vibrations