Geometry & MOs

Info

ID:	287456
PubChem CID:	104242670
Reduced:	BrOC15H21 (1)
Stoich.:	ABC15D21 (1)
Weight, g/mol:	221.152812
ΔH_f, kcal/mol:	-50.27
Dipole, Da:	3.28
IP(EA), eV:	-8.92(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-cyclopentyl-2-(ethoxymethyl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CCC(C2CCCC2)Br

DOS

IR

Vibrations