Geometry & MOs

Info

ID:

162745

PubChem CID:

57565132

Reduced:

SN2O5C22H24 (1)

Stoich.:

AB2C5D22E24 (1)

Weight, g/mol:

792.105

ΔHf, kcal/mol:

-125.7

Dipole, Da:

3.51

IP(EA), eV:

 -9.14(-1.58)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tert-butyl (2'R,3R,4'S)-2'-[2-[tert-butyl(dimethyl)silyl]oxy-5-iodophenyl]-6-chloro-4'-(3-chlorophenyl)-2,6'-dioxospiro[indole-3,3'-piperidine]-1-carboxylate

Drug info:

PubChemData

Smile

[C-]#[N+]C1=CC=C(C=C1)CCN2CCC(CC2)(CS(=O)(=O)C3=CC=C(C=C3)C(=O)O)O

DOS

IR

Vibrations