Geometry & MOs

Info

ID:	374156
PubChem CID:	131324610
Reduced:	BrNSO3H4C9 (1)
Stoich.:	ABCD3E4F9 (1)
Weight, g/mol:	239.007324
ΔH_f, kcal/mol:	11.85
Dipole, Da:	2.92
IP(EA), eV:	-9.56(-2.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-2-(trifluoromethyl)pyridine-3-carbohydrazide

Drug info:

PubChemData

Smile

C1=CC(=C2C=C(SC2=C1[N+](=O)[O-])C=O)Br

DOS

IR

Vibrations