Geometry & MOs

Info

ID:	80611
PubChem CID:	49835497
Reduced:	NO5C28H41 (1)
Stoich.:	AB5C28D41 (1)
Weight, g/mol:	457.282823
ΔH_f, kcal/mol:	-252.24
Dipole, Da:	3.23
IP(EA), eV:	-8.96(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,7-dimethyl-9-bicyclo[3.3.1]nonanyl) 4-[(2-methoxy-2-oxoethoxy)methyl]-4-phenylpiperidine-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1(CCCN(C1)C(=O)OC2C3CC(CC2CC(C3)C)C)CC4=CC=CC=C4OC

DOS

IR

Vibrations