Geometry & MOs

Info

ID:	289703
PubChem CID:	104368728
Reduced:	N3O3C14H15 (1)
Stoich.:	A3B3C14D15 (1)
Weight, g/mol:	278.106671
ΔH_f, kcal/mol:	-37.98
Dipole, Da:	2.92
IP(EA), eV:	-9.63(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dimethoxypyrazin-2-yl)-2-(4-fluorophenyl)ethanol

Drug info:

PubChemData

Smile

CCC1=C(C=CN=C1)C(=O)C2=NC=C(N=C2OC)OC

DOS

IR

Vibrations