Geometry & MOs

Info

ID:	248343
PubChem CID:	103080852
Reduced:	BrN2O3C15H23 (1)
Stoich.:	AB2C3D15E23 (1)
Weight, g/mol:	298.109962
ΔH_f, kcal/mol:	-89.76
Dipole, Da:	1.57
IP(EA), eV:	-8.73(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-cyano-N-[2-[2-(dimethylamino)ethoxy]ethyl]pyridine-3-sulfonamide

Drug info:

PubChemData

Smile

CN(C)CCOCCNCC1=CC2=C(C(=C1)Br)OCCO2

DOS

IR

Vibrations