Geometry & MOs

Info

ID:	233482
PubChem CID:	90944818
Reduced:	H6F15C22 (2)
Stoich.:	A6B15C22 (2)
Weight, g/mol:	212.156501
ΔH_f, kcal/mol:	-1191.36
Dipole, Da:	3.45
IP(EA), eV:	-9.76(-2.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,7,9-trimethyl-4,5,6,9-tetrahydro-3H-fluorene

Drug info:

Smile

C12C(C(=C(C(=C1C(=C(C(=C2F)F)F)F)F)F)C3=C(C(=C(C(C3F)F)C4=C(C(=C(C(=C4F)F)C5=C(C(=C(C(C5F)F)C6=C(C(=C(C(C6F)F)C7=C(C8=C(C(C7F)F)C(=C(C(C8F)F)F)F)F)F)F)F)F)F)F)F)F)F

DOS

IR

Vibrations