Geometry & MOs

Info

ID:	403590
PubChem CID:	135060920
Reduced:	O4C33H34 (1)
Stoich.:	A4B33C34 (1)
Weight, g/mol:	286.229666
ΔH_f, kcal/mol:	-96.68
Dipole, Da:	1.42
IP(EA), eV:	-8.84(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(E,2S)-5-cyclopentylpent-3-en-2-yl]-4-[(2-methylpropan-2-yl)oxy]benzene

Drug info:

PubChemData

Smile

CC[C@H]1[C@](O[C@H](O1)CC)(C2=CC(=C(CC2)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)C5=CC=C(C=C5)C

DOS

IR

Vibrations