Geometry & MOs

Info

ID:

440626

PubChem CID:

135230642

Reduced:

FO3N9C30H32 (1)

Stoich.:

AB3C9D30E32 (1)

Weight, g/mol:

586.225243

ΔHf, kcal/mol:

23.64

Dipole, Da:

9.0

IP(EA), eV:

 -8.63(-0.79)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6-[5-[[(4R,5S)-5-(3,4-difluorophenyl)-2-ethyl-1,2-oxazolidin-4-yl]carbamoylamino]-4-methyl-1-phenylpyrazol-3-yl]imidazo[1,2-a]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(N(N=C1C2=CC3=C(N=C2)N(N=C3C)C)C4=CC=CC=C4)NC(=O)N[C@@H]5CN(O[C@H]5C6=CC(=NC=C6)F)CCOC

DOS

IR

Vibrations