Geometry & MOs

Info

ID:	325616
PubChem CID:	126684188
Reduced:	OC19H26 (1)
Stoich.:	AB19C26 (1)
Weight, g/mol:	401.227434
ΔH_f, kcal/mol:	-44.34
Dipole, Da:	3.13
IP(EA), eV:	-9.71(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[[(2S)-1-[(2S,3R)-2-amino-3-hydroxybutanoyl]pyrrolidin-2-yl]-hydroxymethyl]-N-[(2S)-1-amino-3-hydroxy-1-oxopropan-2-yl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC\1CCC(C/C1=C\C(=O)C2=CC=CC=C2)C(C)(C)C

DOS

IR

Vibrations