Geometry & MOs

Info

ID:	324285
PubChem CID:	126677318
Reduced:	ON6H14C19 (1)
Stoich.:	AB6C14D19 (1)
Weight, g/mol:	330.102923
ΔH_f, kcal/mol:	138.36
Dipole, Da:	3.37
IP(EA), eV:	-8.99(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-fluoropyridin-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylpyrrolo[2,1-f][1,2,4]triazine

Drug info:

PubChemData

Smile

COC1=CC=CC(=N1)C2=NN3C=CC=C3C(=N2)N4C=CC5=C4C=CN=C5

DOS

IR

Vibrations