Geometry & MOs

Info

ID:	146702
PubChem CID:	53731822
Reduced:	N2O9C26H46 (1)
Stoich.:	A2B9C26D46 (1)
Weight, g/mol:	499.269573
ΔH_f, kcal/mol:	-475.18
Dipole, Da:	3.0
IP(EA), eV:	-9.51(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-[2-[4-[3-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]propyl]piperazin-1-yl]ethyl]phenyl]-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

CCOC(=O)C(CCCNC(=O)OC(C)(C)C)(C(=O)OCC)OCC1CCN(CC1)C(=O)OC(C)(C)C

DOS

IR

Vibrations