Geometry & MOs

Info

ID:	293534
PubChem CID:	117392553
Reduced:	ClNO2C13H18 (1)
Stoich.:	ABC2D13E18 (1)
Weight, g/mol:	255.102607
ΔH_f, kcal/mol:	-53.67
Dipole, Da:	1.95
IP(EA), eV:	-8.39(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(8-chloro-5-ethyl-2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylethanamine

Drug info:

PubChemData

Smile

CC1=C(C(=C(C=C1C2(CC2)CN)OC)OC)Cl

DOS

IR

Vibrations