Geometry & MOs

Info

ID:	47862
PubChem CID:	10535673
Reduced:	O4C9H18 (1)
Stoich.:	A4B9C18 (1)
Weight, g/mol:	190.09938
ΔH_f, kcal/mol:	-204.36
Dipole, Da:	4.84
IP(EA), eV:	-10.14(1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-methoxycyclohexa-1,4-dien-1-yl)methyl]furan

Drug info:

PubChemData

Smile

C1C[C@@H]([C@@H]([C@H]1CO)CO)[C@@H](CO)O

DOS

IR

Vibrations