Geometry & MOs

Info

ID:

328057

PubChem CID:

126691888

Reduced:

NC6H7 (4)

Stoich.:

AB6C7 (4)

Weight, g/mol:

551.164361

ΔHf, kcal/mol:

87.72

Dipole, Da:

5.04

IP(EA), eV:

 -8.11(-0.34)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-[[6-(3,3-difluoroazetidin-1-yl)-3-(2-methoxyphenyl)pyridin-2-yl]methyl]-5-[3-fluoro-5-(trifluoromethyl)phenyl]-4-methyl-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

CC1=C(C(=NC1)C)C2=CC(=C(C(=C2)N=C)NC)C3=C(C(=CC=C3)N=C(C)C)C

DOS

IR

Vibrations