Geometry & MOs

Info

ID:	47975
PubChem CID:	10536098
Reduced:	O3H10C12 (1)
Stoich.:	A3B10C12 (1)
Weight, g/mol:	202.062994
ΔH_f, kcal/mol:	-52.04
Dipole, Da:	3.71
IP(EA), eV:	-9.66(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(hydroxymethyl)furan-3-yl]-phenylmethanone

Drug info:

PubChemData

Smile

C1[C@@H]([C@@H](OC1=O)C#CC2=CC=CC=C2)O

DOS

IR

Vibrations