Geometry & MOs

Info

ID:	208354
PubChem CID:	80522828
Reduced:	ISN3H10C16 (1)
Stoich.:	ABC3D10E16 (1)
Weight, g/mol:	315.00072
ΔH_f, kcal/mol:	127.77
Dipole, Da:	5.35
IP(EA), eV:	-8.84(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-bromophenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)I)C2=C(C(=C(S2)C#N)N)C3=CN=CC=C3

DOS

IR

Vibrations