Geometry & MOs

Info

ID:	395933
PubChem CID:	135026982
Reduced:	ON2C20H26 (1)
Stoich.:	AB2C20D26 (1)
Weight, g/mol:	374.227721
ΔH_f, kcal/mol:	5.57
Dipole, Da:	2.21
IP(EA), eV:	-8.62(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,4R,12R)-1-[2-tri(propan-2-yl)silyloxyethyl]-2-oxatricyclo[6.3.1.04,12]dodeca-5,7,10-trien-9-one

Drug info:

PubChemData

Smile

CC(CNC(C1=CC=CC=C1)C2=CC=CC=C2)N3CCOCC3

DOS

IR

Vibrations