Geometry & MOs

Info

ID:	358384
PubChem CID:	127295929
Reduced:	N3O3C21H29 (1)
Stoich.:	A3B3C21D29 (1)
Weight, g/mol:	323.177982
ΔH_f, kcal/mol:	-115.44
Dipole, Da:	4.38
IP(EA), eV:	-8.21(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-piperidin-1-yl-N-(5-propyl-1,3,4-thiadiazol-2-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C2CCN(C2)C(=O)NC3=CC4=C(C=C3)OC5(O4)CCCC5

DOS

IR

Vibrations