Geometry & MOs

Info

ID:	262724
PubChem CID:	103312081
Reduced:	N4F6C11H16 (1)
Stoich.:	A4B6C11D16 (1)
Weight, g/mol:	247.079568
ΔH_f, kcal/mol:	-294.64
Dipole, Da:	7.68
IP(EA), eV:	-9.74(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1,1-trifluoro-2-(trifluoromethyl)oct-6-yn-3-amine

Drug info:

PubChemData

Smile

CC(C)N1C(=NC=N1)CC(C(C(F)(F)F)C(F)(F)F)NC

DOS

IR

Vibrations