Geometry & MOs

Info

ID:	411681
PubChem CID:	135084515
Reduced:	RuH10C15 (1)
Stoich.:	AB10C15 (1)
Weight, g/mol:	313.225308
ΔH_f, kcal/mol:	195.34
Dipole, Da:	8.65
IP(EA), eV:	-8.42(-3.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-2-[[(2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]oxycarbonylamino]pentanoic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=[Ru])C3=CC=CC=C32

DOS

IR

Vibrations