Geometry & MOs

Info

ID:	341964
PubChem CID:	127264657
Reduced:	ClNSO3C9H14 (1)
Stoich.:	ABCD3E9F14 (1)
Weight, g/mol:	625.489068
ΔH_f, kcal/mol:	-144.51
Dipole, Da:	7.62
IP(EA), eV:	-9.97(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-6-amino-1-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-1-amino-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]tetradecanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations