Geometry & MOs

Info

ID:	365268
PubChem CID:	127317613
Reduced:	ON5C20H33 (1)
Stoich.:	AB5C20D33 (1)
Weight, g/mol:	341.210327
ΔH_f, kcal/mol:	-32.59
Dipole, Da:	6.6
IP(EA), eV:	-8.37(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-cyclobutylpiperazin-1-yl)-2-oxoethyl]-2,3-dihydro-1H-indene-5-carboxamide

Drug info:

PubChemData

Smile

CCC1CCCCN1C(=O)C(C)NC2CCCN(C2)C3=NN=C(C=C3)C

DOS

IR

Vibrations