Geometry & MOs

Info

ID:	243463
PubChem CID:	99224153
Reduced:	N4O4C21H28 (1)
Stoich.:	A4B4C21D28 (1)
Weight, g/mol:	446.216535
ΔH_f, kcal/mol:	-100.27
Dipole, Da:	2.18
IP(EA), eV:	-8.9(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-N-[1-[2-oxo-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl]piperidin-4-yl]-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1NC(=O)[C@@H](C)N2CCC(CC2)NC(=O)C3=NOC(=C3)C

DOS

IR

Vibrations