Geometry & MOs

Info

ID:	258800
PubChem CID:	103157069
Reduced:	NOC17H27 (1)
Stoich.:	ABC17D27 (1)
Weight, g/mol:	303.144613
ΔH_f, kcal/mol:	-65.87
Dipole, Da:	0.84
IP(EA), eV:	-8.21(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-3-[4-(trifluoromethoxy)anilino]propan-2-ol

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)NCC(CC2CCCC2)O

DOS

IR

Vibrations