Geometry & MOs

Info

ID:	427645
PubChem CID:	135160919
Reduced:	FO2N6H17C19 (1)
Stoich.:	AB2C6D17E19 (1)
Weight, g/mol:	477.228851
ΔH_f, kcal/mol:	12.45
Dipole, Da:	1.99
IP(EA), eV:	-8.9(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(3-ethyl-2-fluoro-5-methoxyphenyl)-N'-[3-(1-methylpyrazol-4-yl)pyrido[2,3-b]pyrazin-6-yl]-N-(oxetan-3-yl)ethane-1,2-diamine

Drug info:

PubChemData

Smile

COC1=CC(=C(C(=C1)OC)F)N(CC2=NC=CN2)C3=NC4=NC=CN=C4C=C3

DOS

IR

Vibrations