Geometry & MOs

Info

ID:	190562
PubChem CID:	78021026
Reduced:	N2C25H52 (1)
Stoich.:	A2B25C52 (1)
Weight, g/mol:	530.216535
ΔH_f, kcal/mol:	-92.92
Dipole, Da:	0.35
IP(EA), eV:	-8.04(2.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-2-hydroxyanilino]-4-(1-phenylpropylamino)cyclobutane-1,2-dione

Drug info:

PubChemData

Smile

CC(C)N(CCC(C)(C)C)C1CCCCC1N(CCC(C)(C)C)C(C)(C)C

DOS

IR

Vibrations