Geometry & MOs

Info

ID:	82766
PubChem CID:	49856487
Reduced:	FO3N5C23H24 (1)
Stoich.:	AB3C5D23E24 (1)
Weight, g/mol:	357.196489
ΔH_f, kcal/mol:	-78.8
Dipole, Da:	2.5
IP(EA), eV:	-8.49(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-1-[3-(cyclopentylamino)-2-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone

Drug info:

PubChemData

Smile

CC(C)(C(=O)N1CCN2C(=NC(=C2NC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)F)C1)N

DOS

IR

Vibrations