Geometry & MOs

Info

ID:	304610
PubChem CID:	124756508
Reduced:	ON5C17H21 (1)
Stoich.:	AB5C17D21 (1)
Weight, g/mol:	362.157661
ΔH_f, kcal/mol:	9.92
Dipole, Da:	4.71
IP(EA), eV:	-8.67(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[(5-ethyl-1,3,4-thiadiazol-2-yl)methyl]-2-(4-fluorophenyl)-2-piperidin-1-ylacetamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N=C(N2)[C@@H](C(C)C)NC(=O)C3=NC=CN3C

DOS

IR

Vibrations