Geometry & MOs

Info

ID:	373699
PubChem CID:	131318899
Reduced:	N2F3H9C11 (1)
Stoich.:	A2B3C9D11 (1)
Weight, g/mol:	215.067032
ΔH_f, kcal/mol:	-115.64
Dipole, Da:	3.82
IP(EA), eV:	-8.99(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(1R)-1-amino-3,3,3-trifluoropropyl]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

C1CC2=C(C=CC(=C2)C#N)N[C@@H]1C(F)(F)F

DOS

IR

Vibrations