Geometry & MOs

Info

ID:	124252
PubChem CID:	50876248
Reduced:	ClNSO3C16H24 (1)
Stoich.:	ABCD3E16F24 (1)
Weight, g/mol:	365.085242
ΔH_f, kcal/mol:	-130.99
Dipole, Da:	4.6
IP(EA), eV:	-9.24(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloro-2-ethoxy-4-methylphenyl)sulfonyl-3,4-dihydro-2H-quinoline

Drug info:

PubChemData

Smile

CCCOC1=C(C=CC(=C1)S(=O)(=O)N(C)C2CCCCC2)Cl

DOS

IR

Vibrations