Geometry & MOs

Info

ID:	212744
PubChem CID:	81061686
Reduced:	BrON4C12H17 (1)
Stoich.:	ABC4D12E17 (1)
Weight, g/mol:	291.11978
ΔH_f, kcal/mol:	2.72
Dipole, Da:	2.0
IP(EA), eV:	-8.44(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)OCCN(C)C1=NC(=CN2C1=NC=C2)Br

DOS

IR

Vibrations