Geometry & MOs

Info

ID:	328684
PubChem CID:	126726542
Reduced:	FON2H11C13 (2)
Stoich.:	ABC2D11E13 (2)
Weight, g/mol:	810.658484
ΔH_f, kcal/mol:	-57.69
Dipole, Da:	3.1
IP(EA), eV:	-9.42(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11,15,15,26,30,30,41,45,45-nonamethyl-1,8,16,23,31,38-hexaoxacyclopentatetracontane-9,24,39-trione

Drug info:

PubChemData

Smile

CCN1C2=C(C=CC(=C2)C(=O)NCC(C#N)(F)F)N=C1C(C3=CC=CC=C3)(C4=CC=CC=C4)O

DOS

IR

Vibrations