Geometry & MOs

Info

ID:	122563
PubChem CID:	50812595
Reduced:	ON5C20H29 (1)
Stoich.:	AB5C20D29 (1)
Weight, g/mol:	325.226646
ΔH_f, kcal/mol:	28.52
Dipole, Da:	7.13
IP(EA), eV:	-9.11(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[1-(2,6-dimethylphenyl)tetrazol-5-yl]cyclopentyl]piperidine

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)N2C(=NN=N2)C3(CCCCC3)N4CCOCC4

DOS

IR

Vibrations