Geometry & MOs

Info

ID:	201572
PubChem CID:	79557571
Reduced:	ClN3C11H18 (1)
Stoich.:	AB3C11D18 (1)
Weight, g/mol:	251.188529
ΔH_f, kcal/mol:	0.69
Dipole, Da:	3.43
IP(EA), eV:	-8.75(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-bicyclo[2.2.1]heptanylmethylamino)methyl]cyclopentane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC(CNC1=NC=C(C=N1)Cl)C(C)(C)C

DOS

IR

Vibrations