Geometry & MOs

Info

ID:	136620
PubChem CID:	52075028
Reduced:	N3O5C24H35 (1)
Stoich.:	A3B5C24D35 (1)
Weight, g/mol:	460.281146
ΔH_f, kcal/mol:	-173.94
Dipole, Da:	3.6
IP(EA), eV:	-8.3(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-[[2-(4-ethoxy-3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-N-(3-ethoxypropyl)piperidin-1-ium-4-carboxamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)C2=NC(=C(O2)C)CN3CCC(CC3)C(=O)NCCCOC)OC

DOS

IR

Vibrations