Geometry & MOs

Info

ID:	339825
PubChem CID:	127261834
Reduced:	ClO3N4C19H29 (1)
Stoich.:	AB3C4D19E29 (1)
Weight, g/mol:	316.189926
ΔH_f, kcal/mol:	-136.2
Dipole, Da:	3.4
IP(EA), eV:	-9.6(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-(1H-indol-3-yl)-N-propylpropanamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N)N(CCCCC(C(=O)CCl)N)C(=O)[C@H](CC1=CC=CC=C1)N

DOS

IR

Vibrations