Geometry & MOs

Info

ID:	297202
PubChem CID:	117612857
Reduced:	F2O2N7C24H27 (1)
Stoich.:	A2B2C7D24E27 (1)
Weight, g/mol:	493.18738
ΔH_f, kcal/mol:	-32.95
Dipole, Da:	2.77
IP(EA), eV:	-8.68(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[6-(2-fluoro-3,5-dimethoxyphenyl)imino-3-(1-methylpyrazol-4-yl)pyrido[2,3-b]pyrazin-5-yl]methyl]-3-hydroxypyrrolidin-2-one

Drug info:

PubChemData

Smile

CC(C)NCCN1C(=NC2=C(C(=CC(=C2F)OC)OC)F)C=CC3=NC=C(N=C31)C4=CN(N=C4)C

DOS

IR

Vibrations