Geometry & MOs

Info

ID:	293877
PubChem CID:	117408556
Reduced:	SN3C14H19 (1)
Stoich.:	AB3C14D19 (1)
Weight, g/mol:	261.073198
ΔH_f, kcal/mol:	39.41
Dipole, Da:	0.56
IP(EA), eV:	-8.64(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-3,5-difluoro-4-(piperidin-2-ylmethyl)phenol

Drug info:

PubChemData

Smile

CC1=NC2=C(C=CC=C2S1)CCN3CCNCC3

DOS

IR

Vibrations