Geometry & MOs

Info

ID:	26633
PubChem CID:	794380
Reduced:	SCl2N2O2C12H12 (1)
Stoich.:	AB2C2D2E12F12 (1)
Weight, g/mol:	316.088164
ΔH_f, kcal/mol:	-45.06
Dipole, Da:	5.14
IP(EA), eV:	-9.44(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethoxynaphthalen-1-yl)sulfonyl-2-methylimidazole

Drug info:

PubChemData

Smile

CC(C)C1=NC=CN1S(=O)(=O)C2=C(C=CC(=C2)Cl)Cl

DOS

IR

Vibrations