Geometry & MOs

Info

ID:	12448
PubChem CID:	137933
Reduced:	ON2H8C11 (1)
Stoich.:	AB2C8D11 (1)
Weight, g/mol:	184.063663
ΔH_f, kcal/mol:	45.0
Dipole, Da:	3.47
IP(EA), eV:	-10.0(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

phenyl(pyrazin-2-yl)methanone

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)C2=NC=CN=C2

DOS

IR

Vibrations