Geometry & MOs

Info

ID:	146307
PubChem CID:	53668097
Reduced:	O5C16H28 (1)
Stoich.:	A5B16C28 (1)
Weight, g/mol:	572.29987
ΔH_f, kcal/mol:	-246.04
Dipole, Da:	5.11
IP(EA), eV:	-10.06(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-3-[2,4-bis(phenylmethoxy)phenyl]-5-(4-methylpiperazin-1-yl)-5-oxo-4-(propanoylamino)pentanamide

Drug info:

PubChemData

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C1C[C@H]2[C@H]([C@H]([C@@H]1O2)CCCCO)CCCCOCC(=O)O

DOS

IR

Vibrations