Geometry & MOs

Info

ID:	275480
PubChem CID:	103816410
Reduced:	BrClOSN2C11H14 (1)
Stoich.:	ABCDE2F11G14 (1)
Weight, g/mol:	275.9665
ΔH_f, kcal/mol:	-35.87
Dipole, Da:	8.89
IP(EA), eV:	-9.17(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-bromo-6-chloropyridin-3-yl)-2-methylpropanamide

Drug info:

PubChemData

Smile

CC(C)(C)SCC(=O)NC1=CC(=C(N=C1)Cl)Br

DOS

IR

Vibrations