Geometry & MOs

Info

ID:	134474
PubChem CID:	51702495
Reduced:	SN3O4H15C17 (1)
Stoich.:	AB3C4D15E17 (1)
Weight, g/mol:	400.089993
ΔH_f, kcal/mol:	-59.32
Dipole, Da:	5.63
IP(EA), eV:	-9.22(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-cyclohexylphenyl) 8-chloronaphthalene-1-sulfonate

Drug info:

PubChemData

Smile

COC1=CC=C(C2=CC=CC=C21)S(=O)(=O)NNC(=O)C3=CN=CC=C3

DOS

IR

Vibrations