Geometry & MOs

Info

ID:	395702
PubChem CID:	135026283
Reduced:	NSO3C11H21 (1)
Stoich.:	ABC3D11E21 (1)
Weight, g/mol:	950.151491
ΔH_f, kcal/mol:	-135.1
Dipole, Da:	4.37
IP(EA), eV:	-8.45(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,3,4,5,6-pentafluorophenyl)-5-[3-(2,3,4,5,6-pentafluorophenyl)-2,6-diphenylfuro[3,2-f][1]benzofuran-5-yl]-2,6-diphenylfuro[3,2-f][1]benzofuran

Drug info:

PubChemData

Smile

CCOC(=O)/C=C/CCN[S@@](=O)C(C)(C)C

DOS

IR

Vibrations