Geometry & MOs

Info

ID:

160733

PubChem CID:

57389603

Reduced:

SF3N3O5H24C27 (1)

Stoich.:

AB3C3D5E24F27 (1)

Weight, g/mol:

573.154527

ΔHf, kcal/mol:

-226.04

Dipole, Da:

7.0

IP(EA), eV:

 -9.12(-1.05)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[4-[[5-cyclopropyl-3-[2-(trifluoromethoxy)phenyl]-1,2-oxazol-4-yl]methoxy]piperidin-1-yl]-4-methyl-1,3-benzothiazole-6-carboxylic acid

Drug info:

PubChemData

Smile

C1CC1C2=C(C(=NO2)C3=CC=CC=C3OC(F)(F)F)COC4CCN(CC4)C5=NC6=C(S5)C=CC(=C6)C(=O)O

DOS

IR

Vibrations