Geometry & MOs

Info

ID:	313527
PubChem CID:	126615380
Reduced:	O9C43H70 (1)
Stoich.:	A9B43C70 (1)
Weight, g/mol:	422.412381
ΔH_f, kcal/mol:	-465.96
Dipole, Da:	4.72
IP(EA), eV:	-7.78(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6Z,9Z)-20-(3-pentoxypropoxy)icosa-6,9-diene

Drug info:

PubChemData

Smile

CC(C)OC1=CC(=C(C(=C1OC(C)(C)C)C2C3=C(C(=C(C=C3OC(C)(C)C)OC(C)(C)C)OC(C)(C)C)OC(O2)(C)C)OC(C)(C)C)OC(C)(C)C

DOS

IR

Vibrations