Geometry & MOs

Info

ID:	209048
PubChem CID:	80617014
Reduced:	OSN4C14H18 (1)
Stoich.:	ABC4D14E18 (1)
Weight, g/mol:	296.167083
ΔH_f, kcal/mol:	28.82
Dipole, Da:	5.39
IP(EA), eV:	-8.64(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,5-dimethylcyclohexyl)-5-(propylamino)-1,3,4-thiadiazole-2-carboxamide

Drug info:

PubChemData

Smile

CCCCN(C1=CC=CC=C1)C(=O)C2=NN=C(S2)NC

DOS

IR

Vibrations