Geometry & MOs

Info

ID:	444433
PubChem CID:	135262395
Reduced:	OF2N7H19C21 (1)
Stoich.:	AB2C7D19E21 (1)
Weight, g/mol:	332.127326
ΔH_f, kcal/mol:	-12.59
Dipole, Da:	2.88
IP(EA), eV:	-9.04(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-ethoxypyridin-2-yl)-4-phenoxypyrrolo[2,1-f][1,2,4]triazine

Drug info:

PubChemData

Smile

CC(C)NC(=O)C1=C(C=CN=C1)NC2=NC(=NN3C2=CC=C3)C4=NC(=CC=C4)C(F)F

DOS

IR

Vibrations