Geometry & MOs

Info

ID:	127103
PubChem CID:	50990646
Reduced:	O3C10H10 (1)
Stoich.:	A3B10C10 (1)
Weight, g/mol:	218.066697
ΔH_f, kcal/mol:	-110.99
Dipole, Da:	4.69
IP(EA), eV:	-9.86(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(trifluoromethyl)pyridin-2-yl]azetidin-3-ol

Drug info:

PubChemData

Smile

C1C(C2=CC=CC=C2C1O)C(=O)O

DOS

IR

Vibrations