Geometry & MOs

Info

ID:	5096
PubChem CID:	12582
Reduced:	OC8H14 (1)
Stoich.:	AB8C14 (1)
Weight, g/mol:	126.104465
ΔH_f, kcal/mol:	-44.03
Dipole, Da:	3.79
IP(EA), eV:	-9.94(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethylhex-2-enal

Drug info:

PubChemData

Smile

CCCC=C(CC)C=O

DOS

IR

Vibrations