Geometry & MOs

Info

ID:	217213
PubChem CID:	85087441
Reduced:	NO4C20H25 (1)
Stoich.:	AB4C20D25 (1)
Weight, g/mol:	343.1815
ΔH_f, kcal/mol:	-143.99
Dipole, Da:	2.59
IP(EA), eV:	-9.22(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-O-tert-butyl 2-O-methyl 2-trimethylsilyloxy-7-azabicyclo[2.2.1]heptane-2,7-dicarboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)C12CCC(CN1C=CC2=O)OCC3=CC=CC=C3

DOS

IR

Vibrations