Geometry & MOs

Info

ID:	420305
PubChem CID:	135112368
Reduced:	FO2N4C18H25 (1)
Stoich.:	AB2C4D18E25 (1)
Weight, g/mol:	377.138699
ΔH_f, kcal/mol:	-104.33
Dipole, Da:	6.01
IP(EA), eV:	-9.14(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-acetamidopiperidin-1-yl)-5-(4-fluoro-3-methoxyphenyl)-1,2-oxazole-4-carboxylic acid

Drug info:

PubChemData

Smile

CN1CCCCC1C(=O)N2CCCN(CC2)C(=O)C3=CC(=CN=C3)F

DOS

IR

Vibrations