Geometry & MOs

Info

ID:	20072
PubChem CID:	578683
Reduced:	O2C22H29 (2)
Stoich.:	A2B22C29 (2)
Weight, g/mol:	650.43351
ΔH_f, kcal/mol:	-96.74
Dipole, Da:	4.63
IP(EA), eV:	-8.45(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-decyl-3-methoxy-5-pentylphenyl) 15-(4-methoxyphenyl)pentadeca-2,4,6,8,10,12,14-heptaenoate

Drug info:

PubChemData

Smile

CCCCCCCCCCC1=C(C=C(C=C1OC(=O)C=CC=CC=CC=CC=CC=CC=CC2=CC=C(C=C2)OC)CCCCC)OC

DOS

IR

Vibrations