Geometry & MOs

Info

ID:

215116

PubChem CID:

85084182

Reduced:

NO4C20H35 (2)

Stoich.:

AB4C20D35 (2)

Weight, g/mol:

706.520381

ΔHf, kcal/mol:

-466.28

Dipole, Da:

8.79

IP(EA), eV:

 -9.6(0.71)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[13-[5-[5-(8-hexyl-1,3-dioxocan-4-yl)oxolan-2-yl]oxolan-2-yl]-13-trimethylsilyloxytridecyl]-2-methyl-2H-furan-5-one

Drug info:

PubChemData

Smile

CCCC(=O)CC1CCC(C(O1)CC(=O)NCC(C(C)C(=O)NCCCC2C(CCC3(O2)CCCC(O3)CCC(C)C=C(C)C(C)O)C)O)C

DOS

IR

Vibrations