Geometry & MOs

Info

ID:	405037
PubChem CID:	135072251
Reduced:	BrN2H17C18 (1)
Stoich.:	AB2C17D18 (1)
Weight, g/mol:	301.02814
ΔH_f, kcal/mol:	106.8
Dipole, Da:	3.85
IP(EA), eV:	-9.6(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,2-trifluoro-N-[2-(4-fluorophenyl)phenyl]ethanimidoyl chloride

Drug info:

PubChemData

Smile

[C-]#[N+]CCCC(=NCC1=CC=CC=C1)C2=CC=C(C=C2)Br

DOS

IR

Vibrations