Geometry & MOs

Info

ID:

306515

PubChem CID:

125084382

Reduced:

SN3O5C28H41 (1)

Stoich.:

AB3C5D28E41 (1)

Weight, g/mol:

557.151798

ΔHf, kcal/mol:

-208.87

Dipole, Da:

5.6

IP(EA), eV:

 -8.39(0.05)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2R)-2-[(2,4-dichlorophenyl)methyl-[2-(2-methoxy-5-methyl-N-methylsulfonylanilino)acetyl]amino]-N-(2-methylpropyl)propanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations