Geometry & MOs

Info

ID:	30579
PubChem CID:	841532
Reduced:	SF2N2O2H12C17 (1)
Stoich.:	AB2C2D2E12F17 (1)
Weight, g/mol:	343.124215
ΔH_f, kcal/mol:	-81.56
Dipole, Da:	4.29
IP(EA), eV:	-9.1(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(cyclobutanecarbonylamino)-4-(4-methylphenyl)thiophene-3-carboxylate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OCC(=O)NC2=NC(=CS2)C3=C(C=C(C=C3)F)F

DOS

IR

Vibrations