Geometry & MOs

Info

ID:	222296
PubChem CID:	85296383
Reduced:	FNO5C17H18 (1)
Stoich.:	ABC5D17E18 (1)
Weight, g/mol:	329.199094
ΔH_f, kcal/mol:	-252.94
Dipole, Da:	3.94
IP(EA), eV:	-9.9(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 11-hydroxy-6-methyl-3-azatricyclo[6.2.2.04,9]dodecane-3-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3CC(CCC3OC2=O)F

DOS

IR

Vibrations