Geometry & MOs

Info

ID:	447577
PubChem CID:	135283960
Reduced:	FNO3C19H28 (1)
Stoich.:	ABC3D19E28 (1)
Weight, g/mol:	207.100777
ΔH_f, kcal/mol:	-213.83
Dipole, Da:	3.94
IP(EA), eV:	-9.41(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-pyridazin-4-ylpiperidine-1-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CC[C@H](C[C@@H]1C2=CC=C(C=C2)F)C(C)(C)O

DOS

IR

Vibrations