Geometry & MOs

Info

ID:	262103
PubChem CID:	103270540
Reduced:	OBr2N4C10H10 (1)
Stoich.:	AB2C4D10E10 (1)
Weight, g/mol:	279.183444
ΔH_f, kcal/mol:	59.7
Dipole, Da:	1.71
IP(EA), eV:	-8.74(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(4-ethoxy-3-methoxyphenyl)methylamino]methyl]cyclopentan-1-ol

Drug info:

PubChemData

Smile

C1=C(C=NC(=C1Br)CNCCC2=NC=NO2)Br

DOS

IR

Vibrations