Geometry & MOs

Info

ID:	303943
PubChem CID:	124490949
Reduced:	O3N4C11H20 (1)
Stoich.:	A3B4C11D20 (1)
Weight, g/mol:	256.153541
ΔH_f, kcal/mol:	-98.89
Dipole, Da:	6.74
IP(EA), eV:	-9.69(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2S)-2-[(1S)-2-azido-1-hydroxyethyl]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC[C@H]1[C@@H](CN=[N+]=[N-])O

DOS

IR

Vibrations