Geometry & MOs

Info

ID:	279929
PubChem CID:	103845760
Reduced:	SN2O2C11H20 (1)
Stoich.:	AB2C2D11E20 (1)
Weight, g/mol:	240.183778
ΔH_f, kcal/mol:	-82.46
Dipole, Da:	4.4
IP(EA), eV:	-8.97(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-aminooxan-4-yl)-[(2R,6S)-2,6-dimethylpiperidin-1-yl]methanone

Drug info:

PubChemData

Smile

C=CCSCCNC(=O)C1(CCOCC1)N

DOS

IR

Vibrations