Geometry & MOs

Info

ID:	206092
PubChem CID:	80201819
Reduced:	BrON4C9H9 (1)
Stoich.:	ABC4D9E9 (1)
Weight, g/mol:	203.026566
ΔH_f, kcal/mol:	60.54
Dipole, Da:	4.95
IP(EA), eV:	-9.63(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-amino-1,2,5-thiadiazol-3-yl)pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CCNC1=NC(=NO1)C2=CC(=CN=C2)Br

DOS

IR

Vibrations