Geometry & MOs

Info

ID:	318323
PubChem CID:	126650511
Reduced:	ON5C22H29 (1)
Stoich.:	AB5C22D29 (1)
Weight, g/mol:	503.13225
ΔH_f, kcal/mol:	56.04
Dipole, Da:	5.4
IP(EA), eV:	-9.13(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[5-chloro-2-(2,2,2-trifluoroethoxy)phenyl]-5-methoxy-2-oxopyridin-1-yl]-4-(1-methylcyclobutyl)oxybutanoic acid

Drug info:

PubChemData

Smile

CCC(=O)N(C1CCN(CC1)CCC2=CC=CC=C2)C3=CC=CC=C3.N=[N+]=[N-]

DOS

IR

Vibrations