Geometry & MOs

Info

ID:

433277

PubChem CID:

135173414

Reduced:

SO4N5C29H29 (1)

Stoich.:

AB4C5D29E29 (1)

Weight, g/mol:

626.14237

ΔHf, kcal/mol:

-41.0

Dipole, Da:

3.63

IP(EA), eV:

 -8.7(-0.85)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-hydroxy-1-[2-[(2-iodo-2-methylpropanoyl)amino]-3,3-dimethylbutanoyl]-N-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CN(C)C(=O)C1=CC=CC(=C1)C2=CC(=C(C=C2)OC)S(=O)(=O)NC3=CC=CC(=C3)NC(=NC4=CC=CC=C4)N

DOS

IR

Vibrations