Geometry & MOs

Info

ID:	411421
PubChem CID:	135084246
Reduced:	NO2C11H15 (1)
Stoich.:	AB2C11D15 (1)
Weight, g/mol:	280.05751
ΔH_f, kcal/mol:	-40.79
Dipole, Da:	3.8
IP(EA), eV:	-9.46(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-3-(3-isocyano-2,4-dimethylpentan-3-yl)pyridine

Drug info:

PubChemData

Smile

CCN(C(=O)C1=CC=C(C=C1)C)OC

DOS

IR

Vibrations