Geometry & MOs

Info

ID:	270541
PubChem CID:	103637071
Reduced:	BrSN2O3C11H17 (1)
Stoich.:	ABC2D3E11F17 (1)
Weight, g/mol:	287.093977
ΔH_f, kcal/mol:	-111.96
Dipole, Da:	6.89
IP(EA), eV:	-8.94(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(2-nitrophenyl)methylamino]propyl]methanesulfonamide

Drug info:

PubChemData

Smile

CS(=O)(=O)NCCCNCC1=C(C=CC(=C1)Br)O

DOS

IR

Vibrations