Geometry & MOs

Info

ID:	285528
PubChem CID:	104110036
Reduced:	ClON2C13H27 (1)
Stoich.:	ABC2D13E27 (1)
Weight, g/mol:	287.06332
ΔH_f, kcal/mol:	-89.97
Dipole, Da:	4.64
IP(EA), eV:	-8.72(0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromopentan-2-yl)-4-ethoxypyrimidin-2-amine

Drug info:

PubChemData

Smile

CC(C)N1CCOC(C1)CNC(C)CC(C)Cl

DOS

IR

Vibrations