Geometry & MOs

Info

ID:	79649
PubChem CID:	49829845
Reduced:	NO6C22H27 (1)
Stoich.:	AB6C22D27 (1)
Weight, g/mol:	406.126618
ΔH_f, kcal/mol:	-216.19
Dipole, Da:	10.04
IP(EA), eV:	-8.2(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

2-(9H-fluoren-9-ylmethoxycarbonylamino)-5,5,5-trifluoro-4-methylpentanoate

Drug info:

PubChemData

Smile

CCCOC1=C(C=C(C=C1)C(=O)OC(C)C(=O)NC2=CC=C(C=C2)OCC)OC

DOS

IR

Vibrations