Geometry & MOs

Info

ID:

382075

PubChem CID:

134972996

Reduced:

CuLiON2C11H12 (1)

Stoich.:

ABCD2E11F12 (1)

Weight, g/mol:

892.355611

ΔHf, kcal/mol:

103.96

Dipole, Da:

9.89

IP(EA), eV:

 -7.36(0.87)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4S)-2-[2,10-ditert-butyl-4-[(4S)-4-ethyl-3-(4-methylphenyl)sulfonyl-1,3-oxazolidin-2-yl]-6-propan-2-yloxybenzo[d][1,3,2]benzodioxaphosphepin-8-yl]-4-ethyl-3-(4-methylphenyl)sulfonyl-1,3-oxazolidine

Drug info:

PubChemData

Smile

[Li+].C1COCC[N-]1.C1=CC(=CC=[C-]1)C#N.[Cu+]

DOS

IR

Vibrations