Geometry & MOs

Info

ID:	294408
PubChem CID:	117459535
Reduced:	NF2O2C15H21 (1)
Stoich.:	AB2C2D15E21 (1)
Weight, g/mol:	285.154035
ΔH_f, kcal/mol:	-179.03
Dipole, Da:	2.93
IP(EA), eV:	-8.43(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[7-(1,1-difluoroethyl)-3,4-dihydro-2H-1,5-benzodioxepin-8-yl]-2-methylpropan-2-amine

Drug info:

PubChemData

Smile

CC(C1=C(C(=CC(=C1)C2CCCNC2)OC)OC)(F)F

DOS

IR

Vibrations