Geometry & MOs

Info

ID:	264341
PubChem CID:	103455637
Reduced:	FO2C13H15 (1)
Stoich.:	AB2C13D15 (1)
Weight, g/mol:	218.094294
ΔH_f, kcal/mol:	-107.72
Dipole, Da:	5.75
IP(EA), eV:	-8.79(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-1-(2,3-dihydro-1-benzofuran-7-yl)-2-hydroxyethanone

Drug info:

PubChemData

Smile

CC(=CC(=O)CC1=CC(=C(C=C1)OC)F)C

DOS

IR

Vibrations