Geometry & MOs

Info

ID:	288083
PubChem CID:	104310650
Reduced:	BrClON4H8C13 (1)
Stoich.:	ABCD4E8F13 (1)
Weight, g/mol:	344.02727
ΔH_f, kcal/mol:	78.04
Dipole, Da:	2.93
IP(EA), eV:	-8.76(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(3-bromopyridin-2-yl)-1,2,4-oxadiazol-5-yl]-4,6-dimethylaniline

Drug info:

PubChemData

Smile

C1=CC(=C(N=C1)C2=NOC(=N2)C3=C(C=CC(=C3)N)Cl)Br

DOS

IR

Vibrations