Geometry & MOs

Info

ID:	358006
PubChem CID:	127295520
Reduced:	SO2N4C17H24 (1)
Stoich.:	AB2C4D17E24 (1)
Weight, g/mol:	389.16856
ΔH_f, kcal/mol:	-46.96
Dipole, Da:	7.91
IP(EA), eV:	-8.95(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-fluorophenyl)-5-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]-1,3,4-thiadiazole-2-carboxamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C2CCN(C2)CC3=NS(=O)(=O)C4=CC=CC=C4N3

DOS

IR

Vibrations