Geometry & MOs

Info

ID:	150553
PubChem CID:	53790246
Reduced:	O2N3H7C9 (1)
Stoich.:	A2B3C7D9 (1)
Weight, g/mol:	234.089209
ΔH_f, kcal/mol:	0.8
Dipole, Da:	8.0
IP(EA), eV:	-8.99(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

prop-1-en-2-yl 3-hydroxy-4-prop-1-en-2-yloxybenzoate

Drug info:

PubChemData

Smile

C1=CC(=C2NC=NC=N2)C(=CC1=O)O

DOS

IR

Vibrations