Geometry & MOs

Info

ID:	382178
PubChem CID:	134973153
Reduced:	OC13H18 (1)
Stoich.:	AB13C18 (1)
Weight, g/mol:	432.157288
ΔH_f, kcal/mol:	-15.14
Dipole, Da:	2.06
IP(EA), eV:	-9.02(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2R,6R,7S)-1,2-bis(phenylmethoxymethyl)-3,11-dioxatricyclo[5.3.1.12,6]dodeca-4,8-diene-10,12-dione

Drug info:

PubChemData

Smile

COC12C3C=CC1C2C4C3CCCC4

DOS

IR

Vibrations