Geometry & MOs

Info

ID:	376437
PubChem CID:	134222450
Reduced:	F3O4N8H25C29 (1)
Stoich.:	A3B4C8D25E29 (1)
Weight, g/mol:	342.140691
ΔH_f, kcal/mol:	-177.68
Dipole, Da:	9.07
IP(EA), eV:	-9.42(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(3,4-dimethylphenyl)-1,1,1,3,3-pentafluoropropan-2-yl]-1,2-dimethylbenzene

Drug info:

PubChemData

Smile

C1C(CN(C1C(=O)NC2CC(=O)N(C2)C3=CC(=CC(=C3)F)F)C(=O)CN4C5=C(C=C(C=C5)C6=CN=NC=C6)C(=N4)C(=O)N)F

DOS

IR

Vibrations