Geometry & MOs

Info

ID:	122703
PubChem CID:	50817802
Reduced:	O3N5C21H23 (1)
Stoich.:	A3B5C21D23 (1)
Weight, g/mol:	454.181647
ΔH_f, kcal/mol:	-14.17
Dipole, Da:	3.05
IP(EA), eV:	-9.5(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-difluoro-N-methyl-N-[2-[5-[4-(piperidine-1-carbonyl)phenyl]-1,2,4-oxadiazol-3-yl]ethyl]benzamide

Drug info:

PubChemData

Smile

CCC(=O)N(C)CCC1=NOC(=N1)C2=CC=C(C=C2)C(=O)NCC3=CC=CC=N3

DOS

IR

Vibrations