Geometry & MOs

Info

ID:	203689
PubChem CID:	79858975
Reduced:	SN3O3C8H19 (1)
Stoich.:	AB3C3D8E19 (1)
Weight, g/mol:	318.116877
ΔH_f, kcal/mol:	-123.5
Dipole, Da:	6.46
IP(EA), eV:	-9.27(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-aminobutyl)-3-chloro-N-methyl-N-(2-methylsulfonylethyl)aniline

Drug info:

PubChemData

Smile

CN(CCCC(=O)NN)CCS(=O)(=O)C

DOS

IR

Vibrations