Geometry & MOs

Info

ID:	225732
PubChem CID:	87225405
Reduced:	ClSN6O8C31H39 (1)
Stoich.:	ABC6D8E31F39 (1)
Weight, g/mol:	633.975416
ΔH_f, kcal/mol:	-275.64
Dipole, Da:	9.38
IP(EA), eV:	-8.72(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,5-bis[1,1,1,3,3,3-hexafluoro-2-(2,2,2-trifluoroethoxy)propan-2-yl]-1,3,2-dioxathiane 2,2-dioxide

Drug info:

PubChemData

Smile

CCOCCOCCOCCCNC(=O)CC1=C/C(=C\2/NC3=C(N2)C=C(C=C3)C(=N)N)/C(=O)C(=C1)C4=C(C=CC(=C4)S(=O)(=O)N)O.Cl

DOS

IR

Vibrations