Geometry & MOs

Info

ID:	286198
PubChem CID:	104159731
Reduced:	ON4C11H16 (1)
Stoich.:	AB4C11D16 (1)
Weight, g/mol:	379.04529
ΔH_f, kcal/mol:	3.22
Dipole, Da:	4.68
IP(EA), eV:	-9.34(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-4-methoxy-N-(4-propan-2-yloxybutyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC(CNC(=O)C1=CN=C(C=N1)N)C2CC2

DOS

IR

Vibrations