Geometry & MOs

Info

ID:	168128
PubChem CID:	74927241
Reduced:	BrClN4O5C23H34 (1)
Stoich.:	ABC4D5E23F34 (1)
Weight, g/mol:	585.258019
ΔH_f, kcal/mol:	-247.28
Dipole, Da:	3.08
IP(EA), eV:	-9.09(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[di(propan-2-yloxy)phosphorylmethoxy]ethoxy]-6-[2-[di(propan-2-yloxy)phosphorylmethoxy]propoxy]pyrimidin-2-amine

Drug info:

PubChemData

Smile

CC(C)N(C1CCCNC1)C(=O)C2=CC3=C(C=C2Br)OC(C(=O)N3CCNC(=O)OC)(C)C.Cl

DOS

IR

Vibrations