Geometry & MOs

Info

ID:	29685
PubChem CID:	836457
Reduced:	O3C22H28 (1)
Stoich.:	A3B22C28 (1)
Weight, g/mol:	309.060569
ΔH_f, kcal/mol:	-119.33
Dipole, Da:	1.22
IP(EA), eV:	-8.79(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(3-methylphenoxy)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(C)C)OCC(=O)OC2=C(C=CC(=C2)C)C(C)C

DOS

IR

Vibrations