Geometry & MOs

Info

ID:	294146
PubChem CID:	117427846
Reduced:	ClNO2C14H20 (1)
Stoich.:	ABC2D14E20 (1)
Weight, g/mol:	269.118257
ΔH_f, kcal/mol:	-88.07
Dipole, Da:	5.31
IP(EA), eV:	-8.53(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloro-6-ethyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-methylpropan-2-amine

Drug info:

PubChemData

Smile

CC1=C(C(=CC(=C1OC)Cl)CC2CCCCN2)O

DOS

IR

Vibrations