Geometry & MOs

Info

ID:	183697
PubChem CID:	77059268
Reduced:	ClSN4H7C10 (1)
Stoich.:	ABC4D7E10 (1)
Weight, g/mol:	298.121195
ΔH_f, kcal/mol:	127.15
Dipole, Da:	1.14
IP(EA), eV:	-8.56(-2.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(N'-hydroxycarbamimidoyl)-1-methylpiperidin-4-yl]-4-methylthiadiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=NNSC1=C2N=C3C=CC=C(C3=N2)Cl

DOS

IR

Vibrations