Geometry & MOs

Info

ID:	249255
PubChem CID:	103088098
Reduced:	ClS2N3C11H14 (1)
Stoich.:	AB2C3D11E14 (1)
Weight, g/mol:	263.030226
ΔH_f, kcal/mol:	57.43
Dipole, Da:	3.61
IP(EA), eV:	-8.33(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dichloro-N-(4-methylsulfanylbutyl)aniline

Drug info:

PubChemData

Smile

CSCCCCNC1=C(C=CC2=NSN=C21)Cl

DOS

IR

Vibrations