Geometry & MOs

Info

ID:	390748
PubChem CID:	135000724
Reduced:	OC7H9 (2)
Stoich.:	AB7C9 (2)
Weight, g/mol:	276.172545
ΔH_f, kcal/mol:	-57.44
Dipole, Da:	2.52
IP(EA), eV:	-9.37(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 11-[(2-methylpropan-2-yl)oxy]tetracyclo[5.4.0.02,9.08,10]undec-4-ene-2-carboxylate

Drug info:

PubChemData

Smile

C1C[C@@H]([C@H]2C[C@H]2[C@H]1O)OCC3=CC=CC=C3

DOS

IR

Vibrations