Geometry & MOs

Info

ID:	264160
PubChem CID:	103436121
Reduced:	ClOF2N2C11H15 (1)
Stoich.:	ABC2D2E11F15 (1)
Weight, g/mol:	198.111676
ΔH_f, kcal/mol:	-130.4
Dipole, Da:	5.51
IP(EA), eV:	-9.54(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(5-amino-1,3,4-oxadiazol-2-yl)piperidin-3-yl]methanol

Drug info:

PubChemData

Smile

CC1=C(C(=C(C=C1)C(C(F)(F)Cl)NN)OC)C

DOS

IR

Vibrations