Geometry & MOs

Info

ID:	302061
PubChem CID:	124349089
Reduced:	BrNCl2O3H10C15 (1)
Stoich.:	ABC2D3E10F15 (1)
Weight, g/mol:	458.020305
ΔH_f, kcal/mol:	-67.29
Dipole, Da:	5.81
IP(EA), eV:	-9.14(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-(2-chlorobenzoyl)hydrazinyl]-2-oxoethyl] 4-(2,4-dichlorophenoxy)butanoate

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1NC(=O)COC2=C(C=C(C=C2)Br)C=O)Cl)Cl

DOS

IR

Vibrations