Geometry & MOs

Info

ID:	155969
PubChem CID:	56368531
Reduced:	ClF2N2O4C19H19 (1)
Stoich.:	AB2C2D4E19F19 (1)
Weight, g/mol:	414.243104
ΔH_f, kcal/mol:	-239.78
Dipole, Da:	4.42
IP(EA), eV:	-9.07(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cycloheptylpyrrolidin-3-yl)-3-[3-(4-fluoro-3-methylphenyl)-1,2,4-oxadiazol-5-yl]propanamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CCNC(=O)CNC(=O)C2=CC=CC=C2Cl)OC(F)F

DOS

IR

Vibrations