Geometry & MOs

Info

ID:	21003
PubChem CID:	586703
Reduced:	ON2C11H18 (1)
Stoich.:	AB2C11D18 (1)
Weight, g/mol:	194.141913
ΔH_f, kcal/mol:	-40.58
Dipole, Da:	2.07
IP(EA), eV:	-9.74(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-methyl-6-(3-methylbutyl)pyrazin-2-yl]methanol

Drug info:

PubChemData

Smile

CC1=NC=C(N=C1CO)CCC(C)C

DOS

IR

Vibrations