Geometry & MOs

Info

ID:	121419
PubChem CID:	50767328
Reduced:	FO3N4H23C24 (1)
Stoich.:	AB3C4D23E24 (1)
Weight, g/mol:	450.19032
ΔH_f, kcal/mol:	-47.24
Dipole, Da:	7.36
IP(EA), eV:	-9.1(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dimethoxyphenyl)-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)benzoyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CC1C2=NC(=NO2)C3=CC=C(C=C3)C(=O)N4CCC(CC4)C(=O)NC5=CC=C(C=C5)F

DOS

IR

Vibrations