Geometry & MOs

Info

ID:	209027
PubChem CID:	80615484
Reduced:	ClSO2N4C11H11 (1)
Stoich.:	ABC2D4E11F11 (1)
Weight, g/mol:	270.151433
ΔH_f, kcal/mol:	-8.37
Dipole, Da:	5.45
IP(EA), eV:	-8.7(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,3-dimethylbutan-2-yl)-5-(ethylamino)-N-methyl-1,3,4-thiadiazole-2-carboxamide

Drug info:

PubChemData

Smile

CNC1=NN=C(S1)C(=O)NC2=C(C=CC(=C2)OC)Cl

DOS

IR

Vibrations