Geometry & MOs

Info

ID:	84606
PubChem CID:	49868463
Reduced:	O3C10H12 (1)
Stoich.:	A3B10C12 (1)
Weight, g/mol:	414.036937
ΔH_f, kcal/mol:	-98.89
Dipole, Da:	4.63
IP(EA), eV:	-9.48(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclopenta-1,3-diene;2-(cyclopenta-1,4-dien-1-ylmethoxymethyl)cyclopenta-1,3-diene;iron(2+)

Drug info:

PubChemData

Smile

C1=CC(=C(CCCC(=O)O)O)C=C1

DOS

IR

Vibrations