Geometry & MOs

Info

ID:	266921
PubChem CID:	103580071
Reduced:	BrClN3H11C12 (1)
Stoich.:	ABC3D11E12 (1)
Weight, g/mol:	304.99305
ΔH_f, kcal/mol:	50.6
Dipole, Da:	2.47
IP(EA), eV:	-8.82(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-bromo-3-chloropyridin-2-yl)amino]-2,2-dimethylpropanamide

Drug info:

PubChemData

Smile

CC1=NC=C(C=C1)CNC2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations