Geometry & MOs

Info

ID:	415376
PubChem CID:	135088370
Reduced:	O2N3C16H19 (1)
Stoich.:	A2B3C16D19 (1)
Weight, g/mol:	317.137556
ΔH_f, kcal/mol:	-15.81
Dipole, Da:	7.37
IP(EA), eV:	-9.09(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-morpholin-4-ylethylamino)-5-phenyl-1,2-oxazole-4-carboxylic acid

Drug info:

PubChemData

Smile

CN1C[C@H]2CN([C@@H](C1)COC2)C(=O)C3=CC=CC(=C3)C#N

DOS

IR

Vibrations