Geometry & MOs

Info

ID:	389843
PubChem CID:	134995514
Reduced:	NO2C11H21 (1)
Stoich.:	AB2C11D21 (1)
Weight, g/mol:	178.112443
ΔH_f, kcal/mol:	-75.36
Dipole, Da:	4.34
IP(EA), eV:	-9.0(1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-methoxyoctane

Drug info:

PubChemData

Smile

CCN(CC)C[C@H]([C@H]1CO[C@@H]1C=C)O

DOS

IR

Vibrations