Geometry & MOs

Info

ID:	446434
PubChem CID:	135274939
Reduced:	BrFN2O2H8C11 (1)
Stoich.:	ABC2D2E8F11 (1)
Weight, g/mol:	302.154289
ΔH_f, kcal/mol:	-59.39
Dipole, Da:	5.02
IP(EA), eV:	-9.77(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-4-(2-methylpyrazol-3-yl)-N-piperidin-3-ylbenzamide

Drug info:

PubChemData

Smile

CN1C(=C(C=N1)Br)C2=CC(=C(C=C2)C(=O)O)F

DOS

IR

Vibrations