Geometry & MOs

Info

ID:	427636
PubChem CID:	135160863
Reduced:	FO4N6C22H23 (1)
Stoich.:	AB4C6D22E23 (1)
Weight, g/mol:	466.212867
ΔH_f, kcal/mol:	-77.3
Dipole, Da:	2.59
IP(EA), eV:	-8.73(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[6-(5-ethyl-2-fluoro-3-methoxyphenyl)imino-3-(1-methylpyrazol-4-yl)pyrido[2,3-b]pyrazin-5-yl]-3-methoxypropan-2-ol

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C2=CN=C3C=CC(=NC4=C(C(=CC(=C4)OC)OC)F)N(C3=N2)CC(CO)O

DOS

IR

Vibrations