Geometry & MOs

Info

ID:	399692
PubChem CID:	135041797
Reduced:	C15H22 (1)
Stoich.:	A15B22 (1)
Weight, g/mol:	262.120509
ΔH_f, kcal/mol:	-16.78
Dipole, Da:	0.68
IP(EA), eV:	-9.19(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (1R,10R,12R)-10-methoxy-13-oxatricyclo[8.2.1.02,7]trideca-2,4,6-triene-12-carboxylate

Drug info:

PubChemData

Smile

CC1CCC(C(C1)CC2=CC=CC=C2)C

DOS

IR

Vibrations