Geometry & MOs

Info

ID:	213018
PubChem CID:	81062512
Reduced:	ClO2N4C11H19 (1)
Stoich.:	AB2C4D11E19 (1)
Weight, g/mol:	307.0087
ΔH_f, kcal/mol:	-55.88
Dipole, Da:	3.56
IP(EA), eV:	-9.24(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-chloro-N-methyl-N-(2-propan-2-yloxyethyl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations