Geometry & MOs

Info

ID:	294070
PubChem CID:	117426284
Reduced:	NF2O2C14H17 (1)
Stoich.:	AB2C2D14E17 (1)
Weight, g/mol:	269.122735
ΔH_f, kcal/mol:	-148.88
Dipole, Da:	4.27
IP(EA), eV:	-8.93(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C1(CC1)C2=CC3=C(C=C2C(F)F)OCCO3)N

DOS

IR

Vibrations