Geometry & MOs

Info

ID:	155130
PubChem CID:	56320731
Reduced:	FN3O3H22C26 (1)
Stoich.:	AB3C3D22E26 (1)
Weight, g/mol:	445.167142
ΔH_f, kcal/mol:	-81.03
Dipole, Da:	0.79
IP(EA), eV:	-9.39(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(benzenesulfonyl)-N-[3-[(3-hydroxybenzoyl)amino]propyl]piperidine-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)F)C(=O)NCCCNC(=O)C4=CC(=CC=C4)O

DOS

IR

Vibrations