Geometry & MOs

Info

ID:	184098
PubChem CID:	77108674
Reduced:	ClOSN4C13H19 (1)
Stoich.:	ABCD4E13F19 (1)
Weight, g/mol:	315.082367
ΔH_f, kcal/mol:	13.53
Dipole, Da:	3.95
IP(EA), eV:	-8.98(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-hydroxy-4-methylsulfanyl-1-(4-methylthiadiazole-5-carbonyl)piperidine-4-carboximidamide

Drug info:

PubChemData

Smile

CSC1(CCN(CC1)CC2=C(C=NC=C2)Cl)C(=NO)N

DOS

IR

Vibrations