Geometry & MOs

Info

ID:	123507
PubChem CID:	50851424
Reduced:	O3N4H16C18 (1)
Stoich.:	A3B4C16D18 (1)
Weight, g/mol:	383.184506
ΔH_f, kcal/mol:	-32.3
Dipole, Da:	3.09
IP(EA), eV:	-10.11(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-N-[[4-(dimethylamino)phenyl]methyl]-3-[(3-methoxyphenyl)methyl]-2-oxo-1,3-oxazolidine-4-carboxamide

Drug info:

PubChemData

Smile

C1[C@H](N(C(=O)O1)CC2=CC=CC=C2C#N)C(=O)NCC3=CN=CC=C3

DOS

IR

Vibrations