Geometry & MOs

Info

ID:

306646

PubChem CID:

125093329

Reduced:

ClFSN3O5C36H39 (1)

Stoich.:

ABCD3E5F36G39 (1)

Weight, g/mol:

585.186434

ΔHf, kcal/mol:

-189.09

Dipole, Da:

3.08

IP(EA), eV:

 -8.76(-0.41)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2R)-2-[(3-chlorophenyl)methyl-[2-(4-fluoro-N-(4-methylphenyl)sulfonylanilino)acetyl]amino]-N-cyclopentylpropanamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N(CC2=CC=C(C=C2)Cl)[C@H](CC3=CC=CC=C3)C(=O)NC(C)(C)C)C4=CC=C(C=C4)F

DOS

IR

Vibrations