Geometry & MOs

Info

ID:	173210
PubChem CID:	75611597
Reduced:	BrFN3O3C19H19 (1)
Stoich.:	ABC3D3E19F19 (1)
Weight, g/mol:	442.10842
ΔH_f, kcal/mol:	-102.88
Dipole, Da:	4.19
IP(EA), eV:	-9.02(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[[(4-chlorobenzoyl)hydrazinylidene]methyl]phenyl] 2-naphthalen-1-ylacetate

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)OCC(=O)NN=C(C)CC(=O)NC2=CC=CC=C2F)Br

DOS

IR

Vibrations