Geometry & MOs

Info

ID:	226565
PubChem CID:	87544102
Reduced:	SN2O5C13H22 (1)
Stoich.:	AB2C5D13E22 (1)
Weight, g/mol:	318.124943
ΔH_f, kcal/mol:	-211.67
Dipole, Da:	5.94
IP(EA), eV:	-8.48(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(3E)-3-[(S)-tert-butylsulfinyl]iminopropyl]pyrrolidine-1,2-dicarboxylic acid

Drug info:

PubChemData

Smile

CC(C)(C)S(=O)/N=C/CC[C@]1(CCCN1C(=O)O)C(=O)O

DOS

IR

Vibrations