Geometry & MOs

Info

ID:	214999
PubChem CID:	85083976
Reduced:	ClSF3N4O5C25H30 (1)
Stoich.:	ABC3D4E5F25G30 (1)
Weight, g/mol:	664.16857
ΔH_f, kcal/mol:	-304.83
Dipole, Da:	3.12
IP(EA), eV:	-8.76(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(iodomethyl)-3,4,5,6-tetrakis(phenylmethoxy)cyclohexan-1-ol

Drug info:

PubChemData

Smile

CC(=O)OS(=O)(=O)N(CC=CC1=CC(=CC=C1)C(=N)N)C2=CC(C(C=C2)OC3CCN(CC3)C)(C(F)(F)F)Cl

DOS

IR

Vibrations