Geometry & MOs

Info

ID:	230053
PubChem CID:	87569957
Reduced:	ClSO3N4H15C19 (1)
Stoich.:	ABC3D4E15F19 (1)
Weight, g/mol:	1304.503953
ΔH_f, kcal/mol:	-12.5
Dipole, Da:	7.27
IP(EA), eV:	-9.07(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2,5-bis(oxiran-2-ylmethoxy)-4-[3,5,7-tris[2,4,5-tris(oxiran-2-ylmethoxy)phenyl]-1-adamantyl]phenoxy]methyl]oxirane

Drug info:

PubChemData

Smile

CN1C2=C(C=CC(=C2)C3=CC(=C(N=C3)Cl)NS(=O)(=O)C4=CC=CC=C4)C(=O)N1

DOS

IR

Vibrations