Geometry & MOs

Info

ID:

184338

PubChem CID:

77146855

Reduced:

PN7O8C26H34 (1)

Stoich.:

AB7C8D26E34 (1)

Weight, g/mol:

494.184172

ΔHf, kcal/mol:

-310.0

Dipole, Da:

4.54

IP(EA), eV:

 -8.91(-0.35)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[4-[2-[3-methyl-4-[(2-oxo-4-phenyl-1,3-oxazolidin-3-yl)methyl]-1,2-oxazol-5-yl]phenyl]phenyl]cyclopropane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC(C(=O)OC(C)(C)C)NP(=O)(OCC1C(C(C(O1)N2C=NC3=C2N=C(N=C3OC)N)(C)C#N)O)OC4=CC=CC=C4

DOS

IR

Vibrations