Geometry & MOs

Info

ID:	203733
PubChem CID:	79862941
Reduced:	ON2C13H22 (1)
Stoich.:	AB2C13D22 (1)
Weight, g/mol:	265.150036
ΔH_f, kcal/mol:	-42.69
Dipole, Da:	2.41
IP(EA), eV:	-9.33(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-5-[(3-methylphenyl)methylsulfinyl]cyclopentan-1-amine

Drug info:

PubChemData

Smile

CCCN1C(=CC=N1)C2(CCCC2(C)C)O

DOS

IR

Vibrations