Geometry & MOs

Info

ID:	427629
PubChem CID:	135160837
Reduced:	F2O2N7C25H29 (1)
Stoich.:	A2B2C7D25E29 (1)
Weight, g/mol:	501.223686
ΔH_f, kcal/mol:	-20.41
Dipole, Da:	5.2
IP(EA), eV:	-8.66(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,5-dimethoxyphenyl)-N-[[1-(2-methoxyethyl)-1,2,4-triazol-3-yl]methyl]-3-(1-methylpyrazol-4-yl)pyrido[2,3-b]pyrazin-6-amine

Drug info:

PubChemData

Smile

CC(C)NCCN(C1=C(C(=CC(=C(C1)F)OC)OC)F)C2=NC3=NC(=CN=C3C=C2)C4=CN(N=C4)C

DOS

IR

Vibrations