Geometry & MOs

Info

ID:	62151
PubChem CID:	26717773
Reduced:	N2O3C13H17 (2)
Stoich.:	A2B3C13D17 (2)
Weight, g/mol:	497.162057
ΔH_f, kcal/mol:	-244.29
Dipole, Da:	4.01
IP(EA), eV:	-9.25(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[4-(4-methylpiperidin-1-yl)sulfonylbenzoyl]-5-(phenoxymethyl)furan-2-carbohydrazide

Drug info:

PubChemData

Smile

CCCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)OC3=CC=C(C=C3)C(=O)OCC

DOS

IR

Vibrations