Geometry & MOs

Info

ID:	40590
PubChem CID:	8144385
Reduced:	OS2N4C14H18 (1)
Stoich.:	AB2C4D14E18 (1)
Weight, g/mol:	338.087118
ΔH_f, kcal/mol:	40.46
Dipole, Da:	4.73
IP(EA), eV:	-8.38(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-methoxyanilino)-3-(morpholin-4-ylmethyl)-1,3,4-thiadiazole-2-thione

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC2=NN(C(=S)S2)CN3CCOCC3

DOS

IR

Vibrations