Geometry & MOs

Info

ID:	303187
PubChem CID:	124489332
Reduced:	N2O3C15H22 (1)
Stoich.:	A2B3C15D22 (1)
Weight, g/mol:	246.173213
ΔH_f, kcal/mol:	-103.73
Dipole, Da:	3.75
IP(EA), eV:	-8.98(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,5-dimethylphenyl)-[(3R)-3-(methylaminomethyl)pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CNC[C@H]1CCN(C1)C(=O)C2=CC(=CC(=C2)OC)OC

DOS

IR

Vibrations