Geometry & MOs

Info

ID:	268809
PubChem CID:	103601054
Reduced:	ION2C10H13 (1)
Stoich.:	ABC2D10E13 (1)
Weight, g/mol:	304.101227
ΔH_f, kcal/mol:	-4.91
Dipole, Da:	5.71
IP(EA), eV:	-8.98(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-chlorophenyl)sulfonylethyl]-N',N'-dimethylpropane-1,3-diamine

Drug info:

PubChemData

Smile

CN(C)CC(=O)NC1=CC(=CC=C1)I

DOS

IR

Vibrations