Geometry & MOs

Info

ID:	290480
PubChem CID:	104624184
Reduced:	SN2O3C13H14 (1)
Stoich.:	AB2C3D13E14 (1)
Weight, g/mol:	350.02998
ΔH_f, kcal/mol:	-72.02
Dipole, Da:	1.37
IP(EA), eV:	-10.05(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-(4-methoxy-2,2-dimethylbutyl)pyridine-3-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C#N)S(=O)(=O)N2CCC(=O)CC2

DOS

IR

Vibrations