Geometry & MOs

Info

ID:	424565
PubChem CID:	135123133
Reduced:	SN3O5C25H31 (1)
Stoich.:	AB3C5D25E31 (1)
Weight, g/mol:	367.178358
ΔH_f, kcal/mol:	-170.09
Dipole, Da:	8.54
IP(EA), eV:	-7.95(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(9H-fluoren-9-ylmethylamino)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoic acid

Drug info:

PubChemData

Smile

CN1CCC(CC1)OC2=CC(=CC3=C2NC(=O)C34CCCC4)NS(=O)(=O)C5=CC=CC=C5OC

DOS

IR

Vibrations