Geometry & MOs

Info

ID:	374616
PubChem CID:	131342035
Reduced:	NOF3H8C11 (1)
Stoich.:	ABC3D8E11 (1)
Weight, g/mol:	207.123484
ΔH_f, kcal/mol:	-137.8
Dipole, Da:	3.8
IP(EA), eV:	-10.41(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,3,3-trifluoroprop-1-en-2-yl)cycloheptan-1-amine

Drug info:

PubChemData

Smile

C=C(C(C1=CC=C(C=C1)C#N)O)C(F)(F)F

DOS

IR

Vibrations