Geometry & MOs

Info

ID:	383793
PubChem CID:	134975727
Reduced:	O2Cl3C9H15 (1)
Stoich.:	A2B3C9D15 (1)
Weight, g/mol:	246.125594
ΔH_f, kcal/mol:	-148.82
Dipole, Da:	2.69
IP(EA), eV:	-11.11(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (1R,5R)-1-methoxy-5-phenylbicyclo[3.1.0]hexane-6-carboxylate

Drug info:

PubChemData

Smile

CC(C)COC(=O)CC(C)C(Cl)(Cl)Cl

DOS

IR

Vibrations