Geometry & MOs

Info

ID:	136608
PubChem CID:	52073324
Reduced:	N3O6C29H37 (1)
Stoich.:	A3B6C29D37 (1)
Weight, g/mol:	417.226371
ΔH_f, kcal/mol:	-178.54
Dipole, Da:	3.71
IP(EA), eV:	-8.28(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[2-(2,3-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-N-(2-methoxyethyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(N=C(O1)C2=C(C=C(C=C2)OC)OC)CN3CCC(CC3)C(=O)NCCC4=CC(=C(C=C4)OC)OC

DOS

IR

Vibrations