Geometry & MOs

Info

ID:	259313
PubChem CID:	103163868
Reduced:	NO2C10H15 (1)
Stoich.:	AB2C10D15 (1)
Weight, g/mol:	213.115364
ΔH_f, kcal/mol:	-61.66
Dipole, Da:	2.1
IP(EA), eV:	-9.84(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclobutyl-3-oxo-2-phenylbutanenitrile

Drug info:

PubChemData

Smile

CCOC1CC(C1)CC(=O)CC#N

DOS

IR

Vibrations