Geometry & MOs

Info

ID:	207821
PubChem CID:	80453343
Reduced:	BrFNSO2H13C15 (1)
Stoich.:	ABCDE2F13G15 (1)
Weight, g/mol:	310.115127
ΔH_f, kcal/mol:	-60.43
Dipole, Da:	5.26
IP(EA), eV:	-8.76(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-carbamothioyl-3-fluorophenoxy)-N-cyclopentylpropanamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Br)OCCOC2=CC(=C(C=C2)C(=S)N)F

DOS

IR

Vibrations