Geometry & MOs

Info

ID:	384512
PubChem CID:	134977133
Reduced:	OC11H13 (2)
Stoich.:	AB11C13 (2)
Weight, g/mol:	757.346851
ΔH_f, kcal/mol:	-15.85
Dipole, Da:	3.02
IP(EA), eV:	-8.14(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-methyl-N-[(4S)-13-(1-methyl-2,3,5,8-tetraoxabicyclo[2.2.2]octan-4-yl)trideca-6,9-diyn-4-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

CCCCOC1=CC=C(C=C1)C#CC2=CC=C(C=C2)OCCCC

DOS

IR

Vibrations