Geometry & MOs

Info

ID:	53195
PubChem CID:	14709735
Reduced:	O2N5C10H13 (1)
Stoich.:	A2B5C10D13 (1)
Weight, g/mol:	283.106925
ΔH_f, kcal/mol:	-6.97
Dipole, Da:	3.78
IP(EA), eV:	-8.72(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-hydroxy-2-phenylethyl)amino]-7H-pyrazino[2,3-d]pyridazin-8-one

Drug info:

PubChemData

Smile

CC(CNC1=NN(C(=O)C2=NC=CN=C21)C)O

DOS

IR

Vibrations