Geometry & MOs

Info

ID:	279500
PubChem CID:	103844143
Reduced:	O2N3H13C15 (1)
Stoich.:	A2B3C13D15 (1)
Weight, g/mol:	270.111676
ΔH_f, kcal/mol:	17.5
Dipole, Da:	2.51
IP(EA), eV:	-9.31(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)oxy]phenyl]ethanol

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CCO)OC2=NC3=NC=CN=C3C=C2

DOS

IR

Vibrations