Geometry & MOs

Info

ID:	337043
PubChem CID:	127256608
Reduced:	ClOC9H17 (1)
Stoich.:	ABC9D17 (1)
Weight, g/mol:	202.112443
ΔH_f, kcal/mol:	-89.77
Dipole, Da:	1.84
IP(EA), eV:	-9.82(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4R)-4-chloro-3-cyclohexyloxane

Drug info:

PubChemData

Smile

CCCC[C@H]1COCC[C@@H]1Cl

DOS

IR

Vibrations