Geometry & MOs

Info

ID:	249186
PubChem CID:	103087526
Reduced:	FNSCl2O4C12H14 (1)
Stoich.:	ABCD2E4F12G14 (1)
Weight, g/mol:	279.165686
ΔH_f, kcal/mol:	-214.33
Dipole, Da:	7.47
IP(EA), eV:	-10.1(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclopentyloxy-N-(4-methylsulfanylbutyl)aniline

Drug info:

PubChemData

Smile

CC(C)N(CCC(=O)O)S(=O)(=O)C1=C(C(=C(C=C1)Cl)F)Cl

DOS

IR

Vibrations