Geometry & MOs

Info

ID:	418368
PubChem CID:	135104368
Reduced:	ON2F6C16H16 (1)
Stoich.:	AB2C6D16E16 (1)
Weight, g/mol:	356.130697
ΔH_f, kcal/mol:	-339.93
Dipole, Da:	7.42
IP(EA), eV:	-9.55(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]-thiophen-2-ylmethanol

Drug info:

PubChemData

Smile

C1C[C@H]2CN(CC[C@@H]1N2)C(=O)C3=C(C=C(C=C3)C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations