Geometry & MOs

Info

ID:	142780
PubChem CID:	53090926
Reduced:	O2N6C25H28 (1)
Stoich.:	A2B6C25D28 (1)
Weight, g/mol:	452.105146
ΔH_f, kcal/mol:	21.46
Dipole, Da:	7.26
IP(EA), eV:	-8.19(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloro-4-fluorophenyl)-2-[4,6-dimethyl-2-oxo-3-(3-phenyl-1,2,4-oxadiazol-5-yl)pyridin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=C2C(=NN1C3=CC=CC=C3)C(=NN(C2=O)C(C)C(=O)NCC4=CC=C(C=C4)N(C)C)C

DOS

IR

Vibrations