Geometry & MOs

Info

ID:	260586
PubChem CID:	103196273
Reduced:	F2N2O3C14H14 (1)
Stoich.:	A2B2C3D14E14 (1)
Weight, g/mol:	275.163377
ΔH_f, kcal/mol:	-184.3
Dipole, Da:	1.25
IP(EA), eV:	-9.72(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-(6-propanoylpyridin-3-yl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC2C(CNC2=O)N(C1)C3=C(C=C(C=C3F)C(=O)O)F

DOS

IR

Vibrations