Geometry & MOs

Info

ID:

170911

PubChem CID:

75300185

Reduced:

PN3O8C24H28 (1)

Stoich.:

AB3C8D24E28 (1)

Weight, g/mol:

631.216378

ΔHf, kcal/mol:

-349.9

Dipole, Da:

3.75

IP(EA), eV:

 -8.89(-0.61)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-(3,4-difluorophenyl)-N-[3-hydroxy-4-[[4-(hydroxymethyl)phenyl]sulfonyl-(2-methylpropyl)amino]-1-phenylbutan-2-yl]-2-oxo-1,3-oxazolidine-5-carboxamide

Drug info:

PubChemData

Smile

CC1CN(C(=O)NC1=O)C2C=CC(O2)COP(=O)(NC(C)C(=O)OC)OC3=CC=CC4=CC=CC=C43

DOS

IR

Vibrations