Geometry & MOs

Info

ID:	376458
PubChem CID:	134222472
Reduced:	O2F7C9H11 (1)
Stoich.:	A2B7C9D11 (1)
Weight, g/mol:	264.1701
ΔH_f, kcal/mol:	-472.89
Dipole, Da:	4.02
IP(EA), eV:	-11.28(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1,1-trifluoro-2-(5-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)propan-2-ol

Drug info:

PubChemData

Smile

CC1C(C(OC(C1(F)F)(C(F)(F)F)O)(C)C)(F)F

DOS

IR

Vibrations