Geometry & MOs

Info

ID:	121057
PubChem CID:	50754342
Reduced:	NOC8H9 (3)
Stoich.:	ABC8D9 (3)
Weight, g/mol:	451.210721
ΔH_f, kcal/mol:	-21.4
Dipole, Da:	3.87
IP(EA), eV:	-8.9(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-ethoxyphenyl)-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C2=CC(=NO2)C(=O)NCC(C3=CC=CC=C3)N4CCCC4

DOS

IR

Vibrations