Geometry & MOs

Info

ID:	307819
PubChem CID:	125309553
Reduced:	SN2O2C4H6 (1)
Stoich.:	AB2C2D4E6 (1)
Weight, g/mol:	452.231122
ΔH_f, kcal/mol:	-26.79
Dipole, Da:	4.26
IP(EA), eV:	-9.47(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R,3R)-7-amino-1-(9H-fluoren-9-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxoheptyl] formate

Drug info:

PubChemData

Smile

C1CS[C@@H]2N1NOC2=O

DOS

IR

Vibrations