Geometry & MOs

Info

ID:	405945
PubChem CID:	135076043
Reduced:	CrOC9H14 (1)
Stoich.:	ABC9D14 (1)
Weight, g/mol:	292.1075
ΔH_f, kcal/mol:	118.15
Dipole, Da:	1.63
IP(EA), eV:	-6.81(0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-phenylpropan-2-yl)-4-(1,2,2-trifluoroethenoxy)benzene

Drug info:

PubChemData

Smile

COC(=[Cr])CC1CCCC=C1

DOS

IR

Vibrations