Geometry & MOs

Info

ID:	168985
PubChem CID:	75049713
Reduced:	ClO3N6C19H23 (1)
Stoich.:	AB3C6D19E23 (1)
Weight, g/mol:	585.10231
ΔH_f, kcal/mol:	-73.62
Dipole, Da:	7.63
IP(EA), eV:	-8.79(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-[4-[4-[2-(5-bromo-1H-indol-3-yl)-2-oxoacetyl]piperazin-1-yl]-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

Drug info:

PubChemData

Smile

CCC(CO)NC1=NC(=C2C(=N1)N(C=N2)C(C)C)NC3=CC(=CC(=C3)C(=O)O)Cl

DOS

IR

Vibrations