Geometry & MOs

Info

ID:	439312
PubChem CID:	135229082
Reduced:	SO6N8H24C29 (1)
Stoich.:	AB6C8D24E29 (1)
Weight, g/mol:	288.158626
ΔH_f, kcal/mol:	-61.87
Dipole, Da:	13.79
IP(EA), eV:	-9.03(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[5-(pyridin-2-ylmethoxy)pyrimidin-4-yl]amino]pentan-1-ol

Drug info:

PubChemData

Smile

CNS(=O)(=O)CC1=CC=C(C=C1)N2C(=CC(=O)N2)NC(=O)NC3=CC=C(C4=CC=CC=C43)OC5=C6C(=NC=C5)NC(=O)C=N6

DOS

IR

Vibrations