Geometry & MOs

Info

ID:	149089
PubChem CID:	53788760
Reduced:	OC30H44 (1)
Stoich.:	AB30C44 (1)
Weight, g/mol:	530.360739
ΔH_f, kcal/mol:	-33.02
Dipole, Da:	2.05
IP(EA), eV:	-8.3(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3,5-diacetyloxy-4-(3,7,11,15-tetramethylhexadec-2-enyl)phenyl] acetate

Drug info:

PubChemData

Smile

CCCCC1CCC(CC1)C2CCC(CC2)C=CC#CC3=CC=C(C=C3)OCCCC

DOS

IR

Vibrations