Geometry & MOs

Info

ID:	123505
PubChem CID:	50851375
Reduced:	N4O5C17H18 (1)
Stoich.:	A4B5C17D18 (1)
Weight, g/mol:	336.12224
ΔH_f, kcal/mol:	-138.94
Dipole, Da:	7.73
IP(EA), eV:	-9.91(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-3-[(4-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(=O)O)C(=O)NCCN3C=CC=N3

DOS

IR

Vibrations