Geometry & MOs

Info

ID:	259316
PubChem CID:	103163886
Reduced:	NO2C15H17 (1)
Stoich.:	AB2C15D17 (1)
Weight, g/mol:	151.099714
ΔH_f, kcal/mol:	-26.76
Dipole, Da:	3.93
IP(EA), eV:	-9.03(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclobutyl-2-methyl-3-oxobutanenitrile

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(C#N)C(=O)CC2CCC2

DOS

IR

Vibrations