Geometry & MOs

Info

ID:	261024
PubChem CID:	103214657
Reduced:	ClIN2H12C13 (1)
Stoich.:	ABC2D12E13 (1)
Weight, g/mol:	183.087098
ΔH_f, kcal/mol:	69.9
Dipole, Da:	3.52
IP(EA), eV:	-9.39(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2,2-trifluoroethoxy)pent-4-en-2-amine

Drug info:

PubChemData

Smile

CNC(C1=CC(=C(C=C1)I)Cl)C2=CN=CC=C2

DOS

IR

Vibrations