Geometry & MOs

Info

ID:	322780
PubChem CID:	126671085
Reduced:	FOC10H19 (1)
Stoich.:	ABC10D19 (1)
Weight, g/mol:	188.157643
ΔH_f, kcal/mol:	-137.95
Dipole, Da:	3.73
IP(EA), eV:	-10.2(2.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2S,3S,4S)-2-fluoro-1-methoxy-3-methyl-4-propan-2-ylcyclohexane

Drug info:

PubChemData

Smile

C[C@H]1[C@@H](CC[C@H]([C@H]1F)O)C(C)C

DOS

IR

Vibrations