Geometry & MOs

Info

ID:	259320
PubChem CID:	103163913
Reduced:	NOC12H19 (1)
Stoich.:	ABC12D19 (1)
Weight, g/mol:	179.131014
ΔH_f, kcal/mol:	-36.04
Dipole, Da:	2.74
IP(EA), eV:	-10.44(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-cyclobutylacetyl)pentanenitrile

Drug info:

PubChemData

Smile

CC(C)CC(C#N)C(=O)CC1CCC1

DOS

IR

Vibrations