Geometry & MOs

Info

ID:	439552
PubChem CID:	135229328
Reduced:	FN2O4H15C20 (1)
Stoich.:	AB2C4D15E20 (1)
Weight, g/mol:	145.092521
ΔH_f, kcal/mol:	-125.66
Dipole, Da:	6.08
IP(EA), eV:	-8.89(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4-dimethyl-1-sulfanylpiperidine

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)OCCO)C2=C(C(=O)NC2=O)C3=CNC4=C3C=C(C=C4)F

DOS

IR

Vibrations