Geometry & MOs

Info

ID:	153447
PubChem CID:	56312646
Reduced:	FO3N5C21H26 (1)
Stoich.:	AB3C5D21E26 (1)
Weight, g/mol:	412.125692
ΔH_f, kcal/mol:	-139.17
Dipole, Da:	6.82
IP(EA), eV:	-8.99(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,2-dioxo-2lambda6-thia-3-azatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaen-3-yl)-N-[2-(2-fluorophenyl)-2-methylpropyl]acetamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)CCCN1C=NC2=C1C(=O)N(C(=O)N2C)C)C3=CC=CC=C3F

DOS

IR

Vibrations