Geometry & MOs

Info

ID:	172429
PubChem CID:	75509241
Reduced:	FON2C16H19 (1)
Stoich.:	ABC2D16E19 (1)
Weight, g/mol:	287.14339
ΔH_f, kcal/mol:	-42.7
Dipole, Da:	4.87
IP(EA), eV:	-9.32(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-5-[[4-(2-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]methyl]-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

C1CC1NC(=O)CN2CCC(=CC2)C3=CC=CC=C3F

DOS

IR

Vibrations