Geometry & MOs

Info

ID:	377917
PubChem CID:	134223983
Reduced:	OSN2C14H24 (1)
Stoich.:	ABC2D14E24 (1)
Weight, g/mol:	371.93846
ΔH_f, kcal/mol:	-35.63
Dipole, Da:	3.33
IP(EA), eV:	-9.44(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-5-[2,6-difluoro-4-(trifluoromethyl)phenyl]-1,3-difluorobenzene

Drug info:

PubChemData

Smile

C[C@H](CC(OC(C)(C)C1CCC(=C)C1)SC#N)N

DOS

IR

Vibrations