Geometry & MOs

Info

ID:	304541
PubChem CID:	124756231
Reduced:	NOC9H14 (2)
Stoich.:	ABC9D14 (2)
Weight, g/mol:	266.199428
ΔH_f, kcal/mol:	-60.27
Dipole, Da:	2.25
IP(EA), eV:	-8.07(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(2S)-2-(2-methoxyethyl)piperidin-1-yl]methyl]-5-propan-2-yl-1,2-oxazole

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)CN2CCN3CCC[C@H]3[C@H]2C)OC

DOS

IR

Vibrations