Geometry & MOs

Info

ID:	293402
PubChem CID:	117387237
Reduced:	ClNO2C13H16 (1)
Stoich.:	ABC2D13E16 (1)
Weight, g/mol:	253.086957
ΔH_f, kcal/mol:	-58.95
Dipole, Da:	4.83
IP(EA), eV:	-9.01(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloro-8-methyl-2,3-dihydro-1,4-benzodioxin-7-yl)cyclobutan-1-amine

Drug info:

PubChemData

Smile

C1CC(C1)(C2=C3C(=C(C=C2)Cl)OCCCO3)N

DOS

IR

Vibrations