Geometry & MOs

Info

ID:	266936
PubChem CID:	103580127
Reduced:	BrClON2C10H12 (1)
Stoich.:	ABCD2E10F12 (1)
Weight, g/mol:	300.96175
ΔH_f, kcal/mol:	-22.41
Dipole, Da:	1.22
IP(EA), eV:	-8.93(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridin-2-amine

Drug info:

PubChemData

Smile

C1COCC1CNC2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations