Geometry & MOs

Info

ID:	315482
PubChem CID:	126626959
Reduced:	PC8H13 (1)
Stoich.:	AB8C13 (1)
Weight, g/mol:	292.069812
ΔH_f, kcal/mol:	20.53
Dipole, Da:	1.94
IP(EA), eV:	-9.05(1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1,1-trifluoro-2-[(7R)-2-fluoro-7-(trifluoromethyl)-2-bicyclo[2.2.1]hept-5-enyl]propan-2-ol

Drug info:

PubChemData

Smile

CC1(CC2CC1C=C2)P

DOS

IR

Vibrations