Geometry & MOs

Info

ID:	383324
PubChem CID:	134974984
Reduced:	N2O3C15H18 (1)
Stoich.:	A2B3C15D18 (1)
Weight, g/mol:	376.199822
ΔH_f, kcal/mol:	-110.77
Dipole, Da:	6.54
IP(EA), eV:	-9.56(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-O-benzyl 3-O-tert-butyl (5S)-2-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-dicarboxylate

Drug info:

PubChemData

Smile

C1[C@@H]2CNC(=O)C1CN(C2)C(=O)OCC3=CC=CC=C3

DOS

IR

Vibrations