Geometry & MOs

Info

ID:	383323
PubChem CID:	134974981
Reduced:	N2C21H26 (1)
Stoich.:	A2B21C26 (1)
Weight, g/mol:	274.131742
ΔH_f, kcal/mol:	32.69
Dipole, Da:	3.36
IP(EA), eV:	-8.48(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl (1R)-6-oxo-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate

Drug info:

PubChemData

Smile

C[C@]12CC(CN[C@H]1C3=CC=CC=C3)(C(NC2)C4=CC=CC=C4)C

DOS

IR

Vibrations