Geometry & MOs

Info

ID:	371873
PubChem CID:	131276598
Reduced:	BrON3C7H8 (1)
Stoich.:	ABC3D7E8 (1)
Weight, g/mol:	262.96156
ΔH_f, kcal/mol:	-2.94
Dipole, Da:	2.15
IP(EA), eV:	-10.1(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-3-methyl-5-(methylsulfonylmethyl)pyridine

Drug info:

PubChemData

Smile

CC1=CC(=CN=C1Br)C(=O)NN

DOS

IR

Vibrations