Geometry & MOs

Info

ID:

397140

PubChem CID:

135029781

Reduced:

H15C16 (2)

Stoich.:

A15B16 (2)

Weight, g/mol:

689.489809

ΔHf, kcal/mol:

81.1

Dipole, Da:

0.34

IP(EA), eV:

 -8.76(0.0)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-O-[(2S,3S,4R)-1,1-dihydroxy-2,4,16-trimethylheptadecan-3-yl] 4-O-methyl (2S,3S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-triethylsilyloxybutanedioate

Drug info:

PubChemData

Smile

C1CC2=CC=C(CCC3=C(C=C(CCC4=CC=C1C=C4)C=C3)/C=C/C5=CC=CC=C5)C=C2

DOS

IR

Vibrations