Geometry & MOs

Info

ID:	238912
PubChem CID:	93165719
Reduced:	N2O3C18H26 (1)
Stoich.:	A2B3C18D26 (1)
Weight, g/mol:	318.194343
ΔH_f, kcal/mol:	-135.19
Dipole, Da:	4.08
IP(EA), eV:	-8.33(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-4-methyl-2-[3-[(2R)-2-methyl-2,3-dihydroindol-1-yl]propanoylamino]pentanoic acid

Drug info:

PubChemData

Smile

C[C@@H]1CC2=CC=CC=C2N1[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O

DOS

IR

Vibrations