Geometry & MOs

Info

ID:	8623
PubChem CID:	79636
Reduced:	OC7H12 (1)
Stoich.:	AB7C12 (1)
Weight, g/mol:	112.088815
ΔH_f, kcal/mol:	-34.97
Dipole, Da:	3.08
IP(EA), eV:	-9.82(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethylpent-4-enal

Drug info:

PubChemData

Smile

CC(C)(CC=C)C=O

DOS

IR

Vibrations