Geometry & MOs

Info

ID:	65022
PubChem CID:	29204344
Reduced:	BrFON2Cl3H7C13 (1)
Stoich.:	ABCD2E3F7G13 (1)
Weight, g/mol:	415.025724
ΔH_f, kcal/mol:	-42.6
Dipole, Da:	2.89
IP(EA), eV:	-9.56(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(furan-2-carbonyl)-N'-(2,4,6-trichlorophenyl)piperidine-4-carbohydrazide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1F)C(=O)NNC2=C(C=C(C=C2Cl)Cl)Cl)Br

DOS

IR

Vibrations