Geometry & MOs

Info

ID:

179373

PubChem CID:

76473930

Reduced:

N2O5C24H30 (1)

Stoich.:

A2B5C24D30 (1)

Weight, g/mol:

754.470307

ΔHf, kcal/mol:

-168.06

Dipole, Da:

5.02

IP(EA), eV:

 -8.93(-0.76)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tert-butyl N-methyl-N-[3-[1-(4-methylphenyl)sulfonylimidazol-4-yl]-1-oxo-1-[(1,5,5-tricyclohexyl-3-hydroxypentan-2-yl)amino]propan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)N(C(CCOC1=CC=CC=C1)C=O)C(=O)OCC2=CC=CC=C2)N

DOS

IR

Vibrations