Geometry & MOs

Info

ID:	306187
PubChem CID:	125002271
Reduced:	ON4C15H20 (1)
Stoich.:	AB4C15D20 (1)
Weight, g/mol:	285.15896
ΔH_f, kcal/mol:	39.01
Dipole, Da:	4.02
IP(EA), eV:	-8.7(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3S)-3-[[5-(1H-imidazol-2-yl)pyrazin-2-yl]methyl]piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=CC(=NO1)CN2CCC[C@H]2C3=CC(=NC=C3)NC

DOS

IR

Vibrations