Geometry & MOs

Info

ID:	221544
PubChem CID:	85279410
Reduced:	SiCl3O13C56H71 (1)
Stoich.:	AB3C13D56E71 (1)
Weight, g/mol:	1110.008149
ΔH_f, kcal/mol:	-549.86
Dipole, Da:	3.17
IP(EA), eV:	-8.8(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2,4-tris(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooct-1-enyl)benzene

Drug info:

Smile

CC(C1C=CC(C(O1)C(=O)OCC(Cl)(Cl)Cl)COCC2=CC=CC=C2)OC(=O)C3C(C=CC(O3)C(C)OC(=O)C4C(C=CC(O4)C(C)O[Si](C)(C)C(C)(C)C)COCC5=CC=CC=C5)COCC6=CC=CC=C6

DOS

IR

Vibrations