Geometry & MOs

Info

ID:	140806
PubChem CID:	52764365
Reduced:	N2O5C24H36 (1)
Stoich.:	A2B5C24D36 (1)
Weight, g/mol:	432.262422
ΔH_f, kcal/mol:	-235.87
Dipole, Da:	5.24
IP(EA), eV:	-8.81(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (3R)-3-[(3-methoxyphenyl)methyl-[[(2S)-oxolan-2-yl]methyl]carbamoyl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC[C@@H](C1)C(=O)N(C[C@@H]2CCCO2)CC3=CC(=CC=C3)OC

DOS

IR

Vibrations