Geometry & MOs

Info

ID:	381090
PubChem CID:	134971727
Reduced:	NO3C12H16 (2)
Stoich.:	AB3C12D16 (2)
Weight, g/mol:	332.137222
ΔH_f, kcal/mol:	-264.06
Dipole, Da:	6.18
IP(EA), eV:	-9.13(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2S,4E)-2-benzyl-4-[(hydroxyamino)methylidene]-3,5-dioxopyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)C[C@@H](C(=O)OC)N/C=C\1/C(=O)[C@@H](N(C1=O)C(=O)OC(C)(C)C)CC2=CC=CC=C2

DOS

IR

Vibrations