Geometry & MOs

Info

ID:	137587
PubChem CID:	52230627
Reduced:	N3O4C17H27 (1)
Stoich.:	A3B4C17D27 (1)
Weight, g/mol:	338.207981
ΔH_f, kcal/mol:	-141.8
Dipole, Da:	4.86
IP(EA), eV:	-9.24(0.34)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(3,5-dimethyl-1,2-oxazol-4-yl)methyl-[2-[(2R)-2-ethoxycarbonylpiperidin-1-yl]-2-oxoethyl]-methylazanium

Drug info:

PubChemData

Smile

CCOC(=O)[C@@H]1CCCCN1C(=O)CN(C)CC2=C(ON=C2C)C

DOS

IR

Vibrations