Geometry & MOs

Info

ID:	23352
PubChem CID:	603168
Reduced:	BrO2N3H10C13 (1)
Stoich.:	AB2C3D10E13 (1)
Weight, g/mol:	318.99564
ΔH_f, kcal/mol:	7.32
Dipole, Da:	1.86
IP(EA), eV:	-9.38(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(4-bromobenzoyl)pyridine-3-carbohydrazide

Drug info:

PubChemData

Smile

C1=CC(=CN=C1)C(=O)NNC(=O)C2=CC=C(C=C2)Br

DOS

IR

Vibrations