Geometry & MOs

Info

ID:	53578
PubChem CID:	14716745
Reduced:	O5C32H42 (1)
Stoich.:	A5B32C42 (1)
Weight, g/mol:	478.271924
ΔH_f, kcal/mol:	-210.25
Dipole, Da:	5.9
IP(EA), eV:	-8.9(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[2-(4-methylcyclohex-3-en-1-yl)propoxycarbonyl]phenyl] 4-hexoxybenzoate

Drug info:

PubChemData

Smile

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCC(C)C3CCC(=CC3)C

DOS

IR

Vibrations