Geometry & MOs

Info

ID:	123506
PubChem CID:	50851423
Reduced:	O3N4H16C18 (1)
Stoich.:	A3B4C16D18 (1)
Weight, g/mol:	336.12224
ΔH_f, kcal/mol:	-33.47
Dipole, Da:	5.18
IP(EA), eV:	-10.22(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-3-[(2-cyanophenyl)methyl]-2-oxo-N-(pyridin-3-ylmethyl)-1,3-oxazolidine-4-carboxamide

Drug info:

PubChemData

Smile

C1[C@H](N(C(=O)O1)CC2=CC=C(C=C2)C#N)C(=O)NCC3=CN=CC=C3

DOS

IR

Vibrations