Geometry & MOs

Info

ID:	378567
PubChem CID:	134224658
Reduced:	O2N5C29H35 (1)
Stoich.:	A2B5C29D35 (1)
Weight, g/mol:	282.95119
ΔH_f, kcal/mol:	25.4
Dipole, Da:	6.34
IP(EA), eV:	-8.57(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-6-chloro-5-phenylpyrazin-2-amine

Drug info:

PubChemData

Smile

CC1CC2CC(C1)CC(C2)(C)NC3=C(N=C4N3C=CN=C4)C5=C(C=C(C=C5)C6=C(ON=C6C)C)OC

DOS

IR

Vibrations