Geometry & MOs

Info

ID:	77965
PubChem CID:	49681229
Reduced:	S2O3N5C17H21 (1)
Stoich.:	A2B3C5D17E21 (1)
Weight, g/mol:	395.108582
ΔH_f, kcal/mol:	-51.84
Dipole, Da:	1.68
IP(EA), eV:	-8.81(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethylphenyl)-2-[[5-(2-methoxyethylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide

Drug info:

PubChemData

Smile

COCCNC(=O)NC1=NN=C(S1)SCC(=O)N2CCCC3=CC=CC=C32

DOS

IR

Vibrations