Geometry & MOs

Info

ID:	363766
PubChem CID:	127313406
Reduced:	O3N4C18H30 (1)
Stoich.:	A3B4C18D30 (1)
Weight, g/mol:	323.141596
ΔH_f, kcal/mol:	-142.71
Dipole, Da:	7.31
IP(EA), eV:	-8.59(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]thiadiazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CCN(C(=O)C1)CC(=O)NCCN2CCN(CC2)C(=O)C3CCC3

DOS

IR

Vibrations