Geometry & MOs

Info

ID:	31333
PubChem CID:	855587
Reduced:	ON5C19H27 (1)
Stoich.:	AB5C19D27 (1)
Weight, g/mol:	341.221561
ΔH_f, kcal/mol:	29.33
Dipole, Da:	6.66
IP(EA), eV:	-9.02(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(R)-(1-cyclopentyltetrazol-5-yl)-(4-methylpiperidin-1-yl)methyl]phenol

Drug info:

PubChemData

Smile

CC1CCN(CC1)[C@@H](C2=CC=C(C=C2)O)C3=NN=NN3C4CCCC4

DOS

IR

Vibrations