Geometry & MOs

Info

ID:	293526
PubChem CID:	117392390
Reduced:	ClNO2C13H18 (1)
Stoich.:	ABC2D13E18 (1)
Weight, g/mol:	255.102607
ΔH_f, kcal/mol:	-80.87
Dipole, Da:	1.8
IP(EA), eV:	-8.64(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2-chloro-3,4-dimethoxyphenyl)cyclobutyl]methanamine

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1O)C2(CCCC2)CN)Cl

DOS

IR

Vibrations