Geometry & MOs

Info

ID:	259029
PubChem CID:	103158030
Reduced:	NOSC15H25 (1)
Stoich.:	ABCD15E25 (1)
Weight, g/mol:	279.199843
ΔH_f, kcal/mol:	-57.75
Dipole, Da:	1.37
IP(EA), eV:	-8.87(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-3-[(4-fluoro-3,5-dimethylphenyl)methylamino]propan-2-ol

Drug info:

PubChemData

Smile

CCC1=C(SC=C1)CNCC(CC2CCCC2)O

DOS

IR

Vibrations