Geometry & MOs

Info

ID:	378674
PubChem CID:	134224768
Reduced:	NF3C14H20 (1)
Stoich.:	AB3C14D20 (1)
Weight, g/mol:	231.123484
ΔH_f, kcal/mol:	-167.26
Dipole, Da:	5.03
IP(EA), eV:	-10.33(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hexan-3-yl-4-(trifluoromethyl)pyridine

Drug info:

PubChemData

Smile

CCCCCCC(C)C1=C(N=CC=C1)C(F)(F)F

DOS

IR

Vibrations