Geometry & MOs

Info

ID:	365259
PubChem CID:	127317604
Reduced:	ON5C21H35 (1)
Stoich.:	AB5C21D35 (1)
Weight, g/mol:	307.135448
ΔH_f, kcal/mol:	-34.32
Dipole, Da:	6.07
IP(EA), eV:	-8.36(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-cyclobutylpiperazin-1-yl)-2-oxoethyl]thiophene-3-carboxamide

Drug info:

PubChemData

Smile

CCN(C1CCCCC1)C(=O)C(C)NC2CCCN(C2)C3=NN=C(C=C3)C

DOS

IR

Vibrations