Geometry & MOs

Info

ID:	49695
PubChem CID:	11533576
Reduced:	SO3N6C26H34 (1)
Stoich.:	AB3C6D26E34 (1)
Weight, g/mol:	511.181981
ΔH_f, kcal/mol:	-26.19
Dipole, Da:	6.09
IP(EA), eV:	-8.51(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5,7-bis(4-fluorophenyl)-1-methyl-6-pyridin-4-ylimidazo[4,5-b]pyridin-2-yl]-morpholin-4-ylmethanone

Drug info:

PubChemData

Smile

CC(C)S(=O)(=O)N(C)C1=CC(=CC(=N1)N2CCCC2C=C)C3=NN=C(O3)[C@@](C)(CC4=CC=CC=C4)N

DOS

IR

Vibrations