Geometry & MOs

Info

ID:	243882
PubChem CID:	99300564
Reduced:	ClN2S2O3C21H21 (1)
Stoich.:	AB2C2D3E21F21 (1)
Weight, g/mol:	480.138879
ΔH_f, kcal/mol:	-47.46
Dipole, Da:	3.0
IP(EA), eV:	-8.36(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-(dimethylcarbamoyl)-2-[[2-[2-(4-methoxyphenoxy)ethylsulfanyl]acetyl]amino]-4-methylthiophene-3-carboxylate

Drug info:

PubChemData

Smile

CC(=O)N(C1=CC(=CC=C1)Cl)C2=NC(=CS2)CSCCOC3=CC=C(C=C3)OC

DOS

IR

Vibrations