Geometry & MOs

Info

ID:	252651
PubChem CID:	103112980
Reduced:	ClO2N4C12H17 (1)
Stoich.:	AB2C4D12E17 (1)
Weight, g/mol:	285.04767
ΔH_f, kcal/mol:	-66.04
Dipole, Da:	4.85
IP(EA), eV:	-9.53(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-bromopyridin-3-yl)amino]-N-ethyl-N-methylpropanamide

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NC1=C(C(=NC(=N1)C)Cl)C=O

DOS

IR

Vibrations