Geometry & MOs

Info

ID:	282065
PubChem CID:	103915088
Reduced:	BrON3C11H16 (1)
Stoich.:	ABC3D11E16 (1)
Weight, g/mol:	299.06332
ΔH_f, kcal/mol:	-36.86
Dipole, Da:	4.37
IP(EA), eV:	-8.65(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-bromo-6-methylpyridin-2-yl)amino]-N-tert-butylacetamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=N1)NCC(=O)NC(C)C)Br

DOS

IR

Vibrations