Geometry & MOs

Info

ID:	303550
PubChem CID:	124489889
Reduced:	N2O2C11H11 (2)
Stoich.:	A2B2C11D11 (2)
Weight, g/mol:	332.173607
ΔH_f, kcal/mol:	-130.86
Dipole, Da:	3.42
IP(EA), eV:	-8.86(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S)-2-[3-(4-methoxyindol-1-yl)propanoylamino]-3-methylpentanoic acid

Drug info:

PubChemData

Smile

CCN1C(=O)C2=CC=CC=C2N3[C@@]1(CCC3=O)C(=O)NC4=CC=CC(=C4)NC(=O)C

DOS

IR

Vibrations