Geometry & MOs

Info

ID:	427347
PubChem CID:	135157450
Reduced:	ON6C24H28 (1)
Stoich.:	AB6C24D28 (1)
Weight, g/mol:	524.25696
ΔH_f, kcal/mol:	86.72
Dipole, Da:	3.5
IP(EA), eV:	-8.7(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-[2-[tert-butyl(dimethyl)-lambda4-sulfanyl]ethoxymethyl]pyrazol-4-yl]-N-(3,5-dimethoxyphenyl)pyrido[2,3-b]pyrazin-6-amine

Drug info:

PubChemData

Smile

CC(C)(C#CC1=CC2=C(C=N1)C(=CN2C3=NC(=NC=C3)N)C4CCN(CC4)C5CC5)O

DOS

IR

Vibrations