Geometry & MOs

Info

ID:	365339
PubChem CID:	127317738
Reduced:	OSN6C18H26 (1)
Stoich.:	ABC6D18E26 (1)
Weight, g/mol:	295.146681
ΔH_f, kcal/mol:	18.7
Dipole, Da:	10.04
IP(EA), eV:	-8.42(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclobutyl-N-(5-ethyl-1,3,4-thiadiazol-2-yl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCC1=NN=C(S1)NC(=O)NC2=C(C=C(C=C2)N3CCN(CC3)CC)C

DOS

IR

Vibrations