Geometry & MOs

Info

ID:	155953
PubChem CID:	56368473
Reduced:	ClN3O4C26H26 (1)
Stoich.:	AB3C4D26E26 (1)
Weight, g/mol:	431.184506
ΔH_f, kcal/mol:	-137.89
Dipole, Da:	6.55
IP(EA), eV:	-8.87(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-carbamoylphenyl)methyl]-1-(1-hydroxynaphthalene-2-carbonyl)-N-methylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)C2=C(C3=CC=CC=C3C=C2)O)C(=O)NCCCC(=O)NC4=CC=C(C=C4)Cl

DOS

IR

Vibrations