Geometry & MOs

Info

ID:	25608
PubChem CID:	627082
Reduced:	ClON3H14C16 (1)
Stoich.:	ABC3D14E16 (1)
Weight, g/mol:	333.89538
ΔH_f, kcal/mol:	21.35
Dipole, Da:	2.16
IP(EA), eV:	-8.1(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2,4,5-tetrafluoro-3-(trichloromethyl)-6-(trifluoromethyl)benzene

Drug info:

PubChemData

Smile

COC1=CC2=C(C=CN=C2C(=C1)N)NC3=CC=C(C=C3)Cl

DOS

IR

Vibrations