Geometry & MOs

Info

ID:	155979
PubChem CID:	56368588
Reduced:	FN2O4C25H25 (1)
Stoich.:	AB2C4D25E25 (1)
Weight, g/mol:	437.231456
ΔH_f, kcal/mol:	-162.79
Dipole, Da:	3.61
IP(EA), eV:	-8.91(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclohexanecarbonylamino)ethyl]-1-(1-hydroxynaphthalene-2-carbonyl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)C2=C(C3=CC=CC=C3C=C2)O)C(=O)NCCCOC4=CC=CC=C4F

DOS

IR

Vibrations