Geometry & MOs

Info

ID:	442355
PubChem CID:	135251557
Reduced:	FC2H2 (6)
Stoich.:	AB2C2 (6)
Weight, g/mol:	212.137657
ΔH_f, kcal/mol:	-297.43
Dipole, Da:	5.8
IP(EA), eV:	-10.08(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-tert-butyl-3,5-difluoro-2,4,6-trimethylbenzene

Drug info:

PubChemData

Smile

CC1=C(C(=C(C(=C1F)C(F)(F)F)F)F)C(C)(C)C

DOS

IR

Vibrations