Geometry & MOs

Info

ID:	359799
PubChem CID:	127299843
Reduced:	OSN5C21H25 (1)
Stoich.:	ABC5D21E25 (1)
Weight, g/mol:	345.135638
ΔH_f, kcal/mol:	42.93
Dipole, Da:	1.76
IP(EA), eV:	-9.15(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)pyridin-3-yl]-piperidin-1-ylmethanone

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)C2=CC=CC=N2)N3CCOC(C3)C4=NC(=CS4)C(C)(C)C

DOS

IR

Vibrations