Geometry & MOs

Info

ID:	10222
PubChem CID:	99059
Reduced:	NO3C21H29 (1)
Stoich.:	AB3C21D29 (1)
Weight, g/mol:	343.214744
ΔH_f, kcal/mol:	-129.95
Dipole, Da:	3.07
IP(EA), eV:	-9.03(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(8-methyl-8-azabicyclo[3.2.1]octan-2-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate

Drug info:

PubChemData

Smile

CN1C2CCC1C(CC2)OC(=O)C(C3CCCC3)(C4=CC=CC=C4)O

DOS

IR

Vibrations