Geometry & MOs

Info

ID:

306567

PubChem CID:

125088763

Reduced:

SF3N3O4C26H34 (1)

Stoich.:

AB3C3D4E26F34 (1)

Weight, g/mol:

713.189326

ΔHf, kcal/mol:

-315.21

Dipole, Da:

6.09

IP(EA), eV:

 -9.29(-0.74)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2R)-2-[(2,4-dichlorophenyl)methyl-[2-(N-(4-ethoxyphenyl)sulfonyl-4-fluoroanilino)acetyl]amino]-N-(2-methylpropyl)-3-phenylpropanamide

Drug info:

PubChemData

Smile

CC[C@@H](C)NC(=O)[C@H](CC)N(CC1=CC=C(C=C1)C)C(=O)CN(C2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)C

DOS

IR

Vibrations