Geometry & MOs

Info

ID:	427631
PubChem CID:	135160850
Reduced:	FO3N8C25H27 (1)
Stoich.:	AB3C8D25E27 (1)
Weight, g/mol:	422.206639
ΔH_f, kcal/mol:	17.18
Dipole, Da:	4.31
IP(EA), eV:	-8.54(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(N-[3-[(Z)-1-amino-3-methyliminoprop-1-en-2-yl]pyrido[2,3-b]pyrazin-6-yl]-3,5-dimethoxyanilino)propan-1-ol

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C2=CN=C(C(=N2)N=CN(CC3=NC=CN3CCO)C4=C(C(=CC(=C4)OC)OC)F)C=C

DOS

IR

Vibrations