Geometry & MOs

Info

ID:	225203
PubChem CID:	85747917
Reduced:	ClNOC13H18 (1)
Stoich.:	ABCD13E18 (1)
Weight, g/mol:	240.242929
ΔH_f, kcal/mol:	-39.91
Dipole, Da:	1.92
IP(EA), eV:	-8.85(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

lithium;1,2,3,5-tetra(propan-2-yl)cyclopenta-1,3-diene

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CCN2CCC(C2)Cl

DOS

IR

Vibrations