Geometry & MOs

Info

ID:	326975
PubChem CID:	126688785
Reduced:	ClSO4N7C17H22 (1)
Stoich.:	ABC4D7E17F22 (1)
Weight, g/mol:	1086.428184
ΔH_f, kcal/mol:	-60.33
Dipole, Da:	1.68
IP(EA), eV:	-8.44(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CN1C=C(C=N1)NC2=NC=C(C(=N2)NC3COC4C3OCC4NS(=O)(=O)C5CC5)Cl

DOS

IR

Vibrations