Geometry & MOs

Info

ID:	374613
PubChem CID:	131342031
Reduced:	ClNF3C11H11 (1)
Stoich.:	ABC3D11E11 (1)
Weight, g/mol:	235.154784
ΔH_f, kcal/mol:	-135.35
Dipole, Da:	4.24
IP(EA), eV:	-9.54(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,5-trimethyl-1-(3,3,3-trifluoroprop-1-en-2-yl)cyclohexan-1-amine

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1Cl)(C(=C)C(F)(F)F)N

DOS

IR

Vibrations