Geometry & MOs

Info

ID:	32415
PubChem CID:	7800916
Reduced:	SN4O4C17H22 (1)
Stoich.:	AB4C4D17E22 (1)
Weight, g/mol:	339.074071
ΔH_f, kcal/mol:	-115.42
Dipole, Da:	5.48
IP(EA), eV:	-8.99(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,6-difluoroanilino)-2-oxoethyl] 4-ethyl-5-methylthiophene-2-carboxylate

Drug info:

PubChemData

Smile

CC[C@@H](C)NC(=O)NC(=O)CSC1=NN=C(O1)CC2=CC=C(C=C2)OC

DOS

IR

Vibrations