Geometry & MOs

Info

ID:	156880
PubChem CID:	56394825
Reduced:	SO3N4C25H26 (1)
Stoich.:	AB3C4D25E26 (1)
Weight, g/mol:	460.211055
ΔH_f, kcal/mol:	2.36
Dipole, Da:	6.99
IP(EA), eV:	-8.41(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C2=NC3=C(C(=NO3)C)C(=C2)C(=O)NC4CCN(CC4)C5=CC=C(C=C5)OC

DOS

IR

Vibrations