Geometry & MOs

Info

ID:	275504
PubChem CID:	103816466
Reduced:	BrClN2O2H12C14 (1)
Stoich.:	ABC2D2E12F14 (1)
Weight, g/mol:	395.81574
ΔH_f, kcal/mol:	-28.51
Dipole, Da:	6.38
IP(EA), eV:	-9.24(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-(5-bromo-6-chloropyridin-3-yl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NC2=CC(=C(N=C2)Cl)Br)OC

DOS

IR

Vibrations