Geometry & MOs

Info

ID:	157140
PubChem CID:	56422184
Reduced:	FSO2N4C22H25 (1)
Stoich.:	ABC2D4E22F25 (1)
Weight, g/mol:	420.159769
ΔH_f, kcal/mol:	-94.19
Dipole, Da:	5.76
IP(EA), eV:	-8.87(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(SC2=C1C(=O)N(C=N2)CCC(=O)NC3=C(C=CC(=C3)F)N4CCCCC4)C

DOS

IR

Vibrations