Geometry & MOs

Info

ID:	294310
PubChem CID:	117452646
Reduced:	ClNO2C15H20 (1)
Stoich.:	ABC2D15E20 (1)
Weight, g/mol:	281.118257
ΔH_f, kcal/mol:	-85.63
Dipole, Da:	2.08
IP(EA), eV:	-8.71(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(6-chloro-5-methyl-2,3-dihydro-1,4-benzodioxin-7-yl)cyclopentyl]methanamine

Drug info:

PubChemData

Smile

CC1(OC2=C(O1)C=C(C(=C2)C3(CCCC3)CN)Cl)C

DOS

IR

Vibrations