Geometry & MOs

Info

ID:	47210
PubChem CID:	10530645
Reduced:	N5O8C26H37 (1)
Stoich.:	A5B8C26D37 (1)
Weight, g/mol:	547.348171
ΔH_f, kcal/mol:	-303.75
Dipole, Da:	4.08
IP(EA), eV:	-9.45(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5E,9E)-11-[tert-butyl(diphenyl)silyl]oxy-2-(1-ethoxyethoxy)-4,5,9-trimethylundeca-5,9-dienenitrile

Drug info:

PubChemData

Smile

CCCCOC(=O)N[C@@H](CN(C)C(=O)CC1CC(=NO1)C2=CC=C(C=C2)/C(=N/C(=O)OC(C)(C)C)/N)C(=O)O

DOS

IR

Vibrations