Geometry & MOs

Info

ID:

214774

PubChem CID:

85083615

Reduced:

NPO9C31H44 (1)

Stoich.:

ABC9D31E44 (1)

Weight, g/mol:

605.371638

ΔHf, kcal/mol:

-433.88

Dipole, Da:

5.51

IP(EA), eV:

 -9.27(0.07)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[7-(4-acetamidopent-2-en-2-yl)-19-methoxy-3,6,13,16-tetramethyl-9-oxo-8-oxatricyclo[14.8.0.017,22]tetracosa-2,4,10,12,14,23-hexaen-21-yl] acetate

Drug info:

PubChemData

Smile

CCCCCC(=O)OCC(COP(OCCNC(=O)OCC1=CC=CC=C1)OC2=CC=CC=C2)OC(=O)CCCCC

DOS

IR

Vibrations