Geometry & MOs

Info

ID:	330016
PubChem CID:	127247003
Reduced:	ON6C18H20 (1)
Stoich.:	AB6C18D20 (1)
Weight, g/mol:	336.169859
ΔH_f, kcal/mol:	49.47
Dipole, Da:	6.52
IP(EA), eV:	-8.63(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone

Drug info:

PubChemData

Smile

CC1=CN2C=C(N=C2C=C1)C(=O)N3CCCC3C4=CN=CC(=N4)NC

DOS

IR

Vibrations