Geometry & MOs

Info

ID:	144726
PubChem CID:	53403245
Reduced:	ClFNO2H7C10 (1)
Stoich.:	ABCD2E7F10 (1)
Weight, g/mol:	273.970272
ΔH_f, kcal/mol:	-98.0
Dipole, Da:	2.04
IP(EA), eV:	-9.16(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-chlorosulfonyl-1-benzofuran-7-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=CC2=CC(=CC(=C2N1)F)Cl

DOS

IR

Vibrations