Geometry & MOs

Info

ID:	7246
PubChem CID:	71694
Reduced:	NO3C16H23 (1)
Stoich.:	AB3C16D23 (1)
Weight, g/mol:	277.167794
ΔH_f, kcal/mol:	-125.68
Dipole, Da:	2.22
IP(EA), eV:	-8.56(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,5-dimethylpyrrolidin-1-yl)propyl 2-hydroxybenzoate

Drug info:

PubChemData

Smile

CC1CCC(N1CCCOC(=O)C2=CC=CC=C2O)C

DOS

IR

Vibrations