Geometry & MOs

Info

ID:	354489
PubChem CID:	127287038
Reduced:	OSN5C19H25 (1)
Stoich.:	ABC5D19E25 (1)
Weight, g/mol:	271.171834
ΔH_f, kcal/mol:	7.47
Dipole, Da:	2.5
IP(EA), eV:	-8.74(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(dimethylamino)-N-(thian-4-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCC1C2=NC(=NN2)C3=CC=CC=C3)C(=O)NC4CCSCC4

DOS

IR

Vibrations