Geometry & MOs

Info

ID:

168308

PubChem CID:

74950740

Reduced:

SN5O9C33H47 (1)

Stoich.:

AB5C9D33E47 (1)

Weight, g/mol:

973.742942

ΔHf, kcal/mol:

-382.78

Dipole, Da:

3.04

IP(EA), eV:

 -9.32(-1.1)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[3-hydroxy-1-[2,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl]oxyoctadec-4-en-2-yl]tetracosanamide

Drug info:

PubChemData

Smile

CCOC(=O)C=CCCC(C(=O)NC(CCC(=O)N)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)OC)NC(=O)C=CC2=CSC=C2

DOS

IR

Vibrations