Geometry & MOs

Info

ID:	156879
PubChem CID:	56394824
Reduced:	N2F3O3C22H25 (1)
Stoich.:	A2B3C3D22E25 (1)
Weight, g/mol:	462.172562
ΔH_f, kcal/mol:	-240.73
Dipole, Da:	4.0
IP(EA), eV:	-8.3(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-methoxyphenyl)piperidin-4-yl]-3-methyl-6-(5-methylthiophen-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)N2CCC(CC2)NC(=O)C3=CC=C(C=C3)COCC(F)(F)F

DOS

IR

Vibrations