Geometry & MOs

Info

ID:	303964
PubChem CID:	124491031
Reduced:	NO4C13H21 (1)
Stoich.:	AB4C13D21 (1)
Weight, g/mol:	258.194343
ΔH_f, kcal/mol:	-197.66
Dipole, Da:	5.97
IP(EA), eV:	-9.82(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2S)-2-[(2S)-1-amino-2-hydroxybutan-2-yl]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCCC[C@@H]1/C=C/C(=O)O

DOS

IR

Vibrations