Geometry & MOs

Info

ID:	403805
PubChem CID:	135061935
Reduced:	NH6C7 (2)
Stoich.:	AB6C7 (2)
Weight, g/mol:	396.138639
ΔH_f, kcal/mol:	65.48
Dipole, Da:	2.05
IP(EA), eV:	-8.67(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-fluorophenyl)-4-phenoxy-3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridin-6-amine

Drug info:

PubChemData

Smile

CC1=CNC2=C1C=C(C=N2)C3=CC=CC=C3

DOS

IR

Vibrations