Geometry & MOs

Info

ID:

164158

PubChem CID:

74382116

Reduced:

SN3O7C30H41 (1)

Stoich.:

AB3C7D30E41 (1)

Weight, g/mol:

591.261436

ΔHf, kcal/mol:

-267.06

Dipole, Da:

11.27

IP(EA), eV:

 -9.33(-0.62)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl N-[3-amino-1-(4-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butan-2-yl]carbamate

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)S(=O)(=O)N(CC2CCCC2)CC(C(CC3=CC=CC=C3)NC(=O)OC4COC5C4CCO5)N

DOS

IR

Vibrations