Geometry & MOs

Info

ID:	260414
PubChem CID:	103190519
Reduced:	ON4C16H24 (1)
Stoich.:	AB4C16D24 (1)
Weight, g/mol:	362.06636
ΔH_f, kcal/mol:	29.3
Dipole, Da:	4.58
IP(EA), eV:	-8.87(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-[1-(dimethylamino)propan-2-yl]-N-ethyl-3-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CCN(C(C)CN(C)C)C(=O)C1=CN=CC(=C1)C#CCN

DOS

IR

Vibrations