Geometry & MOs

Info

ID:	25096
PubChem CID:	618952
Reduced:	NOH9C12 (2)
Stoich.:	ABC9D12 (2)
Weight, g/mol:	576.091099
ΔH_f, kcal/mol:	53.43
Dipole, Da:	5.42
IP(EA), eV:	-9.44(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	-24

Chem-info

IUPAC name:

methylcyclopentane;prop-1-ene;zirconium

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=NN2C3=CC=CC=C3)C(=O)CC(=O)C4=CC=CC=C4

DOS

IR

Vibrations