Geometry & MOs

Info

ID:	438636
PubChem CID:	135228380
Reduced:	O3N5C12H25 (1)
Stoich.:	A3B5C12D25 (1)
Weight, g/mol:	573.279863
ΔH_f, kcal/mol:	-162.42
Dipole, Da:	4.72
IP(EA), eV:	-9.78(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,5-dioxocyclopentyl) 5-[[(2S)-1-[[(2S)-5-(carbamoylamino)-1-(4-methylanilino)-1-oxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-5-oxopentanoate

Drug info:

PubChemData

Smile

CC(C)[C@@H](C(=O)N[C@@H](CCCNC(=O)N)C(=O)NC)N

DOS

IR

Vibrations