Geometry & MOs

Info

ID:	259150
PubChem CID:	103158384
Reduced:	NOC14H27 (1)
Stoich.:	ABC14D27 (1)
Weight, g/mol:	321.110726
ΔH_f, kcal/mol:	-68.32
Dipole, Da:	1.55
IP(EA), eV:	-9.06(2.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-chloro-5-(trifluoromethyl)anilino]-3-cyclopentylpropan-2-ol

Drug info:

PubChemData

Smile

C1CCC(C1)CC(CNCCCC2CC2)O

DOS

IR

Vibrations