Geometry & MOs

Info

ID:	8303
PubChem CID:	76248
Reduced:	NOC9H15 (1)
Stoich.:	ABC9D15 (1)
Weight, g/mol:	153.115364
ΔH_f, kcal/mol:	-32.41
Dipole, Da:	5.98
IP(EA), eV:	-10.1(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethyl-4-formylhexanenitrile

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations