Geometry & MOs

Info

ID:	427643
PubChem CID:	135160900
Reduced:	FO2N5C26H28 (1)
Stoich.:	AB2C5D26E28 (1)
Weight, g/mol:	458.243024
ΔH_f, kcal/mol:	7.2
Dipole, Da:	4.84
IP(EA), eV:	-8.4(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(cyclohexylmethyl)-N-(3,5-dimethoxyphenyl)-3-(1-methylpyrazol-4-yl)pyrido[2,3-b]pyrazin-6-imine

Drug info:

PubChemData

Smile

C/C=C(\C=C)/C1=CN=C2C=CC(=NC3=C(C(=CC(=C3)OC)OC)F)N(C2=N1)CC4CCC(=C)N4

DOS

IR

Vibrations