Geometry & MOs

Info

ID:	439247
PubChem CID:	135229014
Reduced:	N2C13H16 (1)
Stoich.:	A2B13C16 (1)
Weight, g/mol:	273.184112
ΔH_f, kcal/mol:	96.95
Dipole, Da:	3.44
IP(EA), eV:	-8.76(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-tert-butyl-2-(2-pyridin-2-ylpropan-2-yl)-2,3-dihydro-1H-pyrazin-6-one

Drug info:

PubChemData

Smile

CCCCC1C2=CC=CC=C2C3=CNN13

DOS

IR

Vibrations