Geometry & MOs

Info

ID:	155887
PubChem CID:	56368132
Reduced:	F2S2N3O3H15C20 (1)
Stoich.:	A2B2C3D3E15F20 (1)
Weight, g/mol:	437.231456
ΔH_f, kcal/mol:	-121.17
Dipole, Da:	5.7
IP(EA), eV:	-9.39(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[1-(1-hydroxynaphthalene-2-carbonyl)pyrrolidine-2-carbonyl]piperidin-3-yl]-2-methylpropanamide

Drug info:

PubChemData

Smile

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)NCCC(=O)NC3=NC4=CC(=C(C=C4S3)F)F

DOS

IR

Vibrations