Geometry & MOs

Info

ID:	322757
PubChem CID:	126671037
Reduced:	OC10H18 (1)
Stoich.:	AB10C18 (1)
Weight, g/mol:	158.147079
ΔH_f, kcal/mol:	-79.66
Dipole, Da:	3.81
IP(EA), eV:	-9.82(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@H]1CCC(=O)C[C@H]1C(C)C

DOS

IR

Vibrations