Geometry & MOs

Info

ID:	144036
PubChem CID:	53303511
Reduced:	FN7H18C21 (1)
Stoich.:	AB7C18D21 (1)
Weight, g/mol:	387.160772
ΔH_f, kcal/mol:	90.73
Dipole, Da:	11.81
IP(EA), eV:	-8.82(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[3-(3-fluorophenyl)-7-methylimidazo[1,2-a]pyridin-2-yl]ethyl]-7H-purin-6-amine

Drug info:

PubChemData

Smile

CC1=CN2C(=NC(=C2C3=CC(=CC=C3)F)C(C)NC4=NC=NC5=C4NC=N5)C=C1

DOS

IR

Vibrations