Geometry & MOs

Info

ID:	271384
PubChem CID:	103672801
Reduced:	ClOSBr2N2H11C13 (1)
Stoich.:	ABCD2E2F11G13 (1)
Weight, g/mol:	415.86527
ΔH_f, kcal/mol:	22.46
Dipole, Da:	3.29
IP(EA), eV:	-8.94(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dibromo-N-[3-(cyanomethoxy)phenyl]thiophene-3-carboxamide

Drug info:

PubChemData

Smile

CN(C)C1=C(C=CC=C1Cl)NC(=O)C2=C(SC(=C2)Br)Br

DOS

IR

Vibrations