Geometry & MOs

Info

ID:

306507

PubChem CID:

125084168

Reduced:

SN3O4C33H43 (1)

Stoich.:

AB3C4D33E43 (1)

Weight, g/mol:

582.267605

ΔHf, kcal/mol:

-150.21

Dipole, Da:

4.8

IP(EA), eV:

 -8.91(0.13)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2R)-2-[[2-[N-(dimethylsulfamoyl)-4-fluoroanilino]acetyl]-[(2-methylphenyl)methyl]amino]-N-(2-methylpropyl)-3-phenylpropanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN([C@H](CC2=CC=CC=C2)C(=O)NCC(C)C)C(=O)CCCN(C3=CC=CC(=C3)C)S(=O)(=O)C

DOS

IR

Vibrations