Geometry & MOs

Info

ID:	325629
PubChem CID:	126684240
Reduced:	ISN4O9C34H59 (1)
Stoich.:	ABC4D9E34F59 (1)
Weight, g/mol:	369.226371
ΔH_f, kcal/mol:	-468.91
Dipole, Da:	5.66
IP(EA), eV:	-9.44(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(dimethylamino)-2-[6-(2-hydroxy-5-oxo-2H-pyrrol-1-yl)hexanoylamino]hexanoic acid

Drug info:

PubChemData

Smile

C[C@@H](C(=O)SN[C@@H](CCCCNC(=O)CC[C@@H](C(=O)O)NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)I)NC(=O)C

DOS

IR

Vibrations