Geometry & MOs

Info

ID:	15628
PubChem CID:	446285
Reduced:	OC9H17 (2)
Stoich.:	AB9C17 (2)
Weight, g/mol:	282.25588
ΔH_f, kcal/mol:	-147.17
Dipole, Da:	4.77
IP(EA), eV:	-9.59(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-octadec-12-enoic acid

Drug info:

PubChemData

Smile

CCCCC/C=C\CCCCCCCCCCC(=O)O

DOS

IR

Vibrations