Geometry & MOs

Info

ID:	374620
PubChem CID:	131342039
Reduced:	NF3C12H14 (1)
Stoich.:	AB3C12D14 (1)
Weight, g/mol:	233.082762
ΔH_f, kcal/mol:	-138.07
Dipole, Da:	3.32
IP(EA), eV:	-9.36(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-fluorophenyl)-3-(trifluoromethyl)but-3-en-2-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(C)(C(=C)C(F)(F)F)N

DOS

IR

Vibrations