Geometry & MOs

Info

ID:

233650

PubChem CID:

91147646

Reduced:

SN2O4H16C21 (1)

Stoich.:

AB2C4D16E21 (1)

Weight, g/mol:

661.347549

ΔHf, kcal/mol:

-67.21

Dipole, Da:

6.33

IP(EA), eV:

 -9.27(-2.04)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2S)-2-amino-5-(methylamino)pentanoic acid;(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenylpropanoyl]amino]-5-(methylamino)pentanoic acid

Drug info:

PubChemData

Smile

C=CCN1C(=O)C(=CC2=CC=CC=C2C3=CC(=CC=C3)C(=O)O)C(=O)NC1=S

DOS

IR

Vibrations