Geometry & MOs

Info

ID:	146216
PubChem CID:	53651962
Reduced:	NO2C18H24 (2)
Stoich.:	AB2C18D24 (2)
Weight, g/mol:	216.012217
ΔH_f, kcal/mol:	-143.49
Dipole, Da:	3.49
IP(EA), eV:	-8.45(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-bis(trifluoromethyl)pyrazine

Drug info:

PubChemData

Smile

CCN(COC1=C2C3=C(C[C@@H]4[C@H]5[C@]3(CCN4CC(=O)C)[C@@H](O2)CCC5)C=C1)C(=O)CCCCCCCC6=CC=CC=C6

DOS

IR

Vibrations