Geometry & MOs

Info

ID:	383374
PubChem CID:	134975062
Reduced:	CH2 (17)
Stoich.:	AB2 (17)
Weight, g/mol:	559.181078
ΔH_f, kcal/mol:	-68.41
Dipole, Da:	0.56
IP(EA), eV:	-9.09(1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2R)-3-ethylsulfanyl-2-[3-[[(2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-sulfanylpropanoyl]amino]propanoylamino]propanoate

Drug info:

PubChemData

Smile

CCCCCCCCC(=CCCC)CCCC

DOS

IR

Vibrations