Geometry & MOs

Info

ID:	436666
PubChem CID:	135207229
Reduced:	N3O5C15H21 (1)
Stoich.:	A3B5C15D21 (1)
Weight, g/mol:	443.25842
ΔH_f, kcal/mol:	-192.69
Dipole, Da:	9.18
IP(EA), eV:	-8.63(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(4,4-dimethylpiperidin-1-yl)-5-(6-fluoro-2-methylpyridin-3-yl)-2-methylpyridin-3-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCNC(=C1C=CC(=O)C=C1)NC(=O)O

DOS

IR

Vibrations