Geometry & MOs

Info

ID:

215309

PubChem CID:

85084526

Reduced:

SO6N8C43H50 (1)

Stoich.:

AB6C8D43E50 (1)

Weight, g/mol:

806.518028

ΔHf, kcal/mol:

-176.48

Dipole, Da:

6.83

IP(EA), eV:

 -8.61(-0.51)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[10,11-diacetyloxy-14-[5-[1-acetyloxy-8-(3-butyloxiran-2-yl)octyl]oxolan-2-yl]-1-(2-methyl-5-oxo-2H-furan-4-yl)tetradecan-2-yl] acetate

Drug info:

PubChemData

Smile

C1CNCCC1(C(=O)NC(CC2=CC=CC=C2)C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)NC(CC5=CSC6=CC=CC=C65)C(=O)NC7(CCNCC7)C(=O)O)N

DOS

IR

Vibrations