Geometry & MOs

Info

ID:	155159
PubChem CID:	56320884
Reduced:	SO3N6H14C20 (1)
Stoich.:	AB3C6D14E20 (1)
Weight, g/mol:	479.187878
ΔH_f, kcal/mol:	35.21
Dipole, Da:	11.58
IP(EA), eV:	-8.78(-1.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-hydroxynaphthalene-2-carbonyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)OC2=NC=C(C=C2)NC(=O)C3=CSC(=N3)C4=NC=CC=N4)C(=O)N

DOS

IR

Vibrations