Geometry & MOs

Info

ID:	351336
PubChem CID:	127280224
Reduced:	SN2O2C7H9 (2)
Stoich.:	AB2C2D7E9 (2)
Weight, g/mol:	310.146347
ΔH_f, kcal/mol:	-94.15
Dipole, Da:	6.54
IP(EA), eV:	-9.3(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-methylimidazol-2-yl)methyl]-2-(2-oxo-2-piperidin-1-ylethyl)sulfanylacetamide

Drug info:

PubChemData

Smile

CN1C=CN=C1CNC(=O)C2=CSC(=C2)S(=O)(=O)N3CCOCC3

DOS

IR

Vibrations