Geometry & MOs

Info

ID:	54632
PubChem CID:	17389015
Reduced:	O2N3H17C21 (1)
Stoich.:	A2B3C17D21 (1)
Weight, g/mol:	420.04734
ΔH_f, kcal/mol:	40.92
Dipole, Da:	5.38
IP(EA), eV:	-9.26(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N'-[(Z)-3-oxo-3-(4-phenylphenyl)prop-1-enyl]benzohydrazide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)/C=C\NNC(=O)C3=CN=CC=C3

DOS

IR

Vibrations