Geometry & MOs

Info

ID:	294309
PubChem CID:	117452644
Reduced:	ClNO2C15H20 (1)
Stoich.:	ABC2D15E20 (1)
Weight, g/mol:	281.118257
ΔH_f, kcal/mol:	-75.03
Dipole, Da:	5.48
IP(EA), eV:	-8.9(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(6-chloro-2,2-dimethyl-1,3-benzodioxol-5-yl)cyclopentyl]methanamine

Drug info:

PubChemData

Smile

C1CCC(C1)(CN)C2=C(C=CC3=C2OCCCO3)Cl

DOS

IR

Vibrations