Geometry & MOs

Info

ID:	7026
PubChem CID:	71008
Reduced:	NOC13H15 (1)
Stoich.:	ABC13D15 (1)
Weight, g/mol:	201.115364
ΔH_f, kcal/mol:	-1.66
Dipole, Da:	4.19
IP(EA), eV:	-8.99(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methoxyphenyl)cyclopentane-1-carbonitrile

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2(CCCC2)C#N

DOS

IR

Vibrations