Geometry & MOs

Info

ID:	371988
PubChem CID:	131284431
Reduced:	NOC6H7 (2)
Stoich.:	ABC6D7 (2)
Weight, g/mol:	218.105528
ΔH_f, kcal/mol:	-35.02
Dipole, Da:	5.9
IP(EA), eV:	-9.09(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-hydroxyphenoxy)piperidine-4-carbonitrile

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C(CCCN2)(C#N)O

DOS

IR

Vibrations