Geometry & MOs

Info

ID:	294080
PubChem CID:	117426745
Reduced:	ON3C16H19 (1)
Stoich.:	AB3C16D19 (1)
Weight, g/mol:	269.108565
ΔH_f, kcal/mol:	36.26
Dipole, Da:	2.61
IP(EA), eV:	-8.68(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methoxy-6-methylsulfonylphenyl)cyclopentan-1-amine

Drug info:

PubChemData

Smile

C1CN2CCC1C(C2)C3=CC=C(C=C3)C4=C(ON=C4)N

DOS

IR

Vibrations