Geometry & MOs

Info

ID:	146598
PubChem CID:	53713578
Reduced:	OC4H7 (2)
Stoich.:	AB4C7 (2)
Weight, g/mol:	338.071428
ΔH_f, kcal/mol:	-99.12
Dipole, Da:	2.07
IP(EA), eV:	-9.45(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[[4-(difluoromethoxy)-6-methoxypyrimidin-2-yl]oxymethyl]-3H-2-benzofuran-1-one

Drug info:

PubChemData

Smile

CC=COC(=O)C(C)(C)C

DOS

IR

Vibrations