Geometry & MOs

Info

ID:	315609
PubChem CID:	126628103
Reduced:	NOC4H5 (2)
Stoich.:	ABC4D5 (2)
Weight, g/mol:	278.151809
ΔH_f, kcal/mol:	-45.57
Dipole, Da:	3.43
IP(EA), eV:	-10.11(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[(1E,3Z)-5-hydroxy-3-methylpenta-1,3-dienyl]-7,9-dimethyl-1,4-dioxaspiro[4.5]deca-6,9-dien-8-ol

Drug info:

PubChemData

Smile

CC1=CC(=NN=C1C(=O)OC)C

DOS

IR

Vibrations