Geometry & MOs

Info

ID:	273925
PubChem CID:	103805888
Reduced:	FN3O3C14H18 (1)
Stoich.:	AB3C3D14E18 (1)
Weight, g/mol:	410.90747
ΔH_f, kcal/mol:	-145.27
Dipole, Da:	3.56
IP(EA), eV:	-9.16(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dibromo-N-(2-oxo-2-piperazin-1-ylethyl)thiophene-3-carboxamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)C(=O)NCC(=O)N2CCNCC2)F

DOS

IR

Vibrations