Geometry & MOs

Info

ID:	63195
PubChem CID:	26746642
Reduced:	S2N3O6C22H23 (1)
Stoich.:	A2B3C6D22E23 (1)
Weight, g/mol:	430.075406
ΔH_f, kcal/mol:	-125.42
Dipole, Da:	5.92
IP(EA), eV:	-9.07(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[3-(2-chlorophenyl)sulfanylpropanoyl]-5-(phenoxymethyl)furan-2-carbohydrazide

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)NNC(=O)C2=CC=C(O2)COC3=CC=CC=C3)S(=O)(=O)C4=CC=CS4

DOS

IR

Vibrations