Geometry & MOs

Info

ID:	341076
PubChem CID:	127263511
Reduced:	N2O5C23H34 (1)
Stoich.:	A2B5C23D34 (1)
Weight, g/mol:	302.095437
ΔH_f, kcal/mol:	-240.91
Dipole, Da:	2.89
IP(EA), eV:	-9.41(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-fluorophenyl)methoxymethyl]-2,3-dihydro-1-benzofuran-5-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N(C)C1CCN(CC1)C(=O)CC(CC2=CC=CC=C2)C(=O)OC

DOS

IR

Vibrations