Geometry & MOs

Info

ID:	449851
PubChem CID:	135302119
Reduced:	NOC11H21 (1)
Stoich.:	ABC11D21 (1)
Weight, g/mol:	208.121178
ΔH_f, kcal/mol:	-83.59
Dipole, Da:	4.54
IP(EA), eV:	-9.12(1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-tert-butylpyrazin-2-yl)oxypropan-2-one

Drug info:

PubChemData

Smile

C[C@H]1CCN([C@H]1C)C(=O)C(C)(C)C

DOS

IR

Vibrations