Geometry & MOs

Info

ID:	302978
PubChem CID:	124489057
Reduced:	ClFNO2C11H13 (1)
Stoich.:	ABCD2E11F13 (1)
Weight, g/mol:	229.167794
ΔH_f, kcal/mol:	-109.64
Dipole, Da:	3.84
IP(EA), eV:	-9.01(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[[(1S,3R)-3-methoxycyclohexyl]oxymethyl]morpholine

Drug info:

PubChemData

Smile

C1CO[C@@H](CN1)COC2=C(C=C(C=C2)F)Cl

DOS

IR

Vibrations