Geometry & MOs

Info

ID:	389543
PubChem CID:	134993601
Reduced:	NCl2C5H8 (1)
Stoich.:	AB2C5D8 (1)
Weight, g/mol:	262.115619
ΔH_f, kcal/mol:	42.22
Dipole, Da:	2.86
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.756089
Charge, e:	0

Chem-info

IUPAC name:

1,3-bis(3,3,3-trifluoropropyl)cyclopentane

Drug info:

PubChemData

Smile

CN(C)C1C([C+]1Cl)Cl

DOS

IR

Vibrations