Geometry & MOs

Info

ID:	323269
PubChem CID:	126673916
Reduced:	OC20H36 (2)
Stoich.:	AB20C36 (2)
Weight, g/mol:	584.553232
ΔH_f, kcal/mol:	-170.21
Dipole, Da:	5.19
IP(EA), eV:	-9.82(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-4-[(E)-nonadec-2-enylidene]-3-[(E)-octadec-1-enyl]oxetan-2-one

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCC=C=C1C(C(=O)O1)/C=C/CCCCCCCCCCCCCCCC

DOS

IR

Vibrations