Geometry & MOs

Info

ID:	270536
PubChem CID:	103637065
Reduced:	SN2O4C12H20 (1)
Stoich.:	AB2C4D12E20 (1)
Weight, g/mol:	326.025869
ΔH_f, kcal/mol:	-145.94
Dipole, Da:	2.99
IP(EA), eV:	-8.36(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(3,5-dichloro-2-hydroxyphenyl)methylamino]propyl]methanesulfonamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1O)CNCCCNS(=O)(=O)C

DOS

IR

Vibrations