Geometry & MOs

Info

ID:	294084
PubChem CID:	117426882
Reduced:	NSO3C13H19 (1)
Stoich.:	ABC3D13E19 (1)
Weight, g/mol:	269.108565
ΔH_f, kcal/mol:	-92.62
Dipole, Da:	5.32
IP(EA), eV:	-9.18(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(2-methoxy-4-methylsulfonylphenyl)cyclopropyl]ethanamine

Drug info:

PubChemData

Smile

CC(C1(CC1)C2=CC(=C(C=C2)OC)S(=O)(=O)C)N

DOS

IR

Vibrations