Geometry & MOs

Info

ID:	274032
PubChem CID:	103806599
Reduced:	FO2N3C15H22 (1)
Stoich.:	AB2C3D15E22 (1)
Weight, g/mol:	410.94386
ΔH_f, kcal/mol:	-102.35
Dipole, Da:	3.73
IP(EA), eV:	-8.79(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(CCN1CCNCC1)C(=O)C2=C(C=C(C=C2)OC)F

DOS

IR

Vibrations