Geometry & MOs

Info

ID:	330741
PubChem CID:	127248148
Reduced:	FN3O3C23H28 (1)
Stoich.:	AB3C3D23E28 (1)
Weight, g/mol:	441.181232
ΔH_f, kcal/mol:	-118.86
Dipole, Da:	3.26
IP(EA), eV:	-9.4(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-N-methyl-1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propanoyl]pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1(CCN(C1)C(=O)C2CCCCC2)CC3=CC(=NO3)C4=CC=C(C=C4)F

DOS

IR

Vibrations