Geometry & MOs

Info

ID:	286297
PubChem CID:	104170002
Reduced:	ON2C10H20 (1)
Stoich.:	AB2C10D20 (1)
Weight, g/mol:	254.235814
ΔH_f, kcal/mol:	-54.82
Dipole, Da:	3.32
IP(EA), eV:	-8.73(2.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methoxypropyl)-2-piperidin-4-ylazepane

Drug info:

PubChemData

Smile

CC(CN1C[C@@H]2CCN[C@@H]2C1)OC

DOS

IR

Vibrations