Geometry & MOs

Info

ID:	213057
PubChem CID:	81062698
Reduced:	ClON3C13H22 (1)
Stoich.:	ABC3D13E22 (1)
Weight, g/mol:	277.10413
ΔH_f, kcal/mol:	-42.34
Dipole, Da:	5.33
IP(EA), eV:	-8.89(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(bromomethyl)cyclopentyl]methyl]-2-ethoxy-N-methylethanamine

Drug info:

PubChemData

Smile

CCOCCN(C)C1=CC(=NC(=N1)C(C)(C)C)Cl

DOS

IR

Vibrations