Geometry & MOs

Info

ID:	293472
PubChem CID:	117390756
Reduced:	NF2O2C13H15 (1)
Stoich.:	AB2C2D13E15 (1)
Weight, g/mol:	255.107085
ΔH_f, kcal/mol:	-158.31
Dipole, Da:	4.11
IP(EA), eV:	-8.9(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[6-(difluoromethyl)-2,3-dihydro-1,4-benzodioxin-7-yl]pyrrolidine

Drug info:

PubChemData

Smile

CC1(CCCN1)C2=C3C(=CC(=C2)C(F)F)OCO3

DOS

IR

Vibrations