Geometry & MOs

Info

ID:	264702
PubChem CID:	103483861
Reduced:	ON6C14H20 (1)
Stoich.:	AB6C14D20 (1)
Weight, g/mol:	312.98622
ΔH_f, kcal/mol:	16.59
Dipole, Da:	2.73
IP(EA), eV:	-9.4(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-amino-4-bromo-5-fluorophenoxy)-1-methylpyrazin-2-one

Drug info:

PubChemData

Smile

CC(C)CN1C(=NC=N1)CN2C=NC3=C(C2=O)CCNC3

DOS

IR

Vibrations