Geometry & MOs

Info

ID:	340049
PubChem CID:	127262058
Reduced:	Cl2O4N6C15H24 (1)
Stoich.:	A2B4C6D15E24 (1)
Weight, g/mol:	350.170253
ΔH_f, kcal/mol:	-202.37
Dipole, Da:	5.22
IP(EA), eV:	-10.0(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[(2S)-1-[[(2S)-2-aminopropanoyl]-(pyridine-4-carbonylamino)amino]-1-oxopropan-2-yl]propanamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N[C@@H](C)C(=O)N(C(=O)[C@H](C)N)NC(=O)C1=CC=NC=C1)N.Cl.Cl

DOS

IR

Vibrations