Geometry & MOs

Info

ID:	24914
PubChem CID:	614471
Reduced:	O2N5C9H15 (1)
Stoich.:	A2B5C9D15 (1)
Weight, g/mol:	225.122575
ΔH_f, kcal/mol:	-24.88
Dipole, Da:	4.6
IP(EA), eV:	-9.69(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methoxy-2-(propan-2-ylamino)-6,7-dihydroimidazo[1,2-a][1,3,5]triazin-4-one

Drug info:

PubChemData

Smile

CC(C)NC1=NC(=O)N2CCN(C2=N1)OC

DOS

IR

Vibrations