Geometry & MOs

Info

ID:	195634
PubChem CID:	78712858
Reduced:	N3O5C18H21 (1)
Stoich.:	A3B5C18D21 (1)
Weight, g/mol:	420.168522
ΔH_f, kcal/mol:	-163.23
Dipole, Da:	3.72
IP(EA), eV:	-9.43(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-(oxolan-2-ylmethylamino)ethyl] 2-[5-(4-methylphenyl)-1,3-oxazol-2-yl]benzoate

Drug info:

PubChemData

Smile

CC(C(=O)OCC(=O)N1CCCCC1C(=O)N)OC2=CC=C(C=C2)C#N

DOS

IR

Vibrations