Geometry & MOs

Info

ID:	265258
PubChem CID:	103515335
Reduced:	NSF2O3H9C12 (1)
Stoich.:	ABC2D3E9F12 (1)
Weight, g/mol:	289.058421
ΔH_f, kcal/mol:	-181.62
Dipole, Da:	1.01
IP(EA), eV:	-8.73(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(2,2-difluoroacetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=C(C2=CC=CC=C2S1)NC(=O)C(F)F

DOS

IR

Vibrations