Geometry & MOs

Info

ID:	323270
PubChem CID:	126673917
Reduced:	OC20H36 (2)
Stoich.:	AB20C36 (2)
Weight, g/mol:	536.480461
ΔH_f, kcal/mol:	-181.43
Dipole, Da:	5.16
IP(EA), eV:	-9.13(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z)-4-(15-methoxypentadecylidene)-3-(14-methoxytetradecyl)oxetan-2-one

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCC/C=C/C=C/1\C(C(=O)O1)/C=C/CCCCCCCCCCCCCCCC

DOS

IR

Vibrations