Geometry & MOs

Info

ID:	5003
PubChem CID:	12416
Reduced:	NC5H9 (1)
Stoich.:	AB5C9 (1)
Weight, g/mol:	83.073499
ΔH_f, kcal/mol:	2.8
Dipole, Da:	3.88
IP(EA), eV:	-11.98(1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethylpropanenitrile

Drug info:

PubChemData

Smile

CC(C)(C)C#N

DOS

IR

Vibrations