Geometry & MOs

Info

ID:

132409

PubChem CID:

51359296

Reduced:

ClN2S2O5C36H37 (1)

Stoich.:

AB2C2D5E36F37 (1)

Weight, g/mol:

443.97957

ΔHf, kcal/mol:

-137.12

Dipole, Da:

4.79

IP(EA), eV:

 -9.06(-1.08)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

8-bromo-2-(4-chlorophenyl)-3-[(3-chlorophenyl)methyl]-6-methylimidazo[1,2-a]pyridine

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)[C@@H]2CC(=O)[C@@H]3CN([C@@H](C[C@@H]3N2S(=O)(=O)C4=CC=C(C=C4)C)C5=CC=C(C=C5)C)S(=O)(=O)C6=CC=C(C=C6)Cl

DOS

IR

Vibrations