Geometry & MOs

Info

ID:	180697
PubChem CID:	76670628
Reduced:	N2O3C17H18 (1)
Stoich.:	A2B3C17D18 (1)
Weight, g/mol:	411.9245
ΔH_f, kcal/mol:	-45.57
Dipole, Da:	6.3
IP(EA), eV:	-8.2(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N'-[1-(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)ethyl]benzohydrazide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(=O)NNC(=C2C=CC=C(C2=O)OC)C

DOS

IR

Vibrations