Geometry & MOs

Info

ID:	51906
PubChem CID:	12014671
Reduced:	OC15H24 (1)
Stoich.:	AB15C24 (1)
Weight, g/mol:	236.17763
ΔH_f, kcal/mol:	-30.13
Dipole, Da:	2.72
IP(EA), eV:	-9.32(1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,4S,6S,8E,12S)-1,6,10,10-tetramethyl-5,13-dioxatricyclo[10.1.0.04,6]tridec-8-ene

Drug info:

PubChemData

Smile

C/C/1=C\CC[C@]2([C@@H](O2)CC(/C=C/C1)(C)C)C

DOS

IR

Vibrations