Geometry & MOs

Info

ID:

437409

PubChem CID:

135226270

Reduced:

FO3N9C28H32 (1)

Stoich.:

AB3C9D28E32 (1)

Weight, g/mol:

586.225243

ΔHf, kcal/mol:

4.72

Dipole, Da:

7.59

IP(EA), eV:

 -8.47(-0.73)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[(4R,5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidin-4-yl]-3-(4-methyl-2-phenyl-5-pyrido[2,3-b]pyrazin-7-ylpyrazol-3-yl)urea

Drug info:

PubChemData

Smile

CC1=C(N(N=C1C2=CN=C(N=C2)N(C)C)C3=CC=CC=C3)NC(=O)N[C@@H]4CN(O[C@H]4C5=CC(=NC=C5)F)CCOC

DOS

IR

Vibrations