Geometry & MOs

Info

ID:	276707
PubChem CID:	103824764
Reduced:	NSBr2O3C9H11 (1)
Stoich.:	ABC2D3E9F11 (1)
Weight, g/mol:	288.01095
ΔH_f, kcal/mol:	-88.24
Dipole, Da:	3.08
IP(EA), eV:	-9.8(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-[2-(2-hydroxyethoxy)ethyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1=C(SC(=C1C(=O)NCCOCCO)Br)Br

DOS

IR

Vibrations