Geometry & MOs

Info

ID:	12801
PubChem CID:	145684
Reduced:	OC16H30 (1)
Stoich.:	AB16C30 (1)
Weight, g/mol:	238.229666
ΔH_f, kcal/mol:	-82.4
Dipole, Da:	3.57
IP(EA), eV:	-10.01(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hexadec-2-enal

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCC=CC=O

DOS

IR

Vibrations