Geometry & MOs

Info

ID:	374227
PubChem CID:	131325618
Reduced:	IN2C10H13 (1)
Stoich.:	AB2C10D13 (1)
Weight, g/mol:	219.137162
ΔH_f, kcal/mol:	21.14
Dipole, Da:	2.47
IP(EA), eV:	-8.42(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,4-dimethylpyridin-3-yl)-piperazin-1-ylmethanone

Drug info:

PubChemData

Smile

C1CC2=CC(=C(C=C2C[C@@H]1N)N)I

DOS

IR

Vibrations