Geometry & MOs

Info

ID:	65011
PubChem CID:	29204331
Reduced:	Cl3N3O3H12C16 (1)
Stoich.:	A3B3C3D12E16 (1)
Weight, g/mol:	417.925953
ΔH_f, kcal/mol:	-76.14
Dipole, Da:	5.23
IP(EA), eV:	-9.25(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-4-oxo-N'-(2,4,6-trichlorophenyl)chromene-2-carbohydrazide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)NC(=O)[C@H](O2)CC(=O)NNC3=C(C=C(C=C3Cl)Cl)Cl

DOS

IR

Vibrations