Geometry & MOs

Info

ID:	189412
PubChem CID:	77851933
Reduced:	FN3O4C16H20 (1)
Stoich.:	AB3C4D16E20 (1)
Weight, g/mol:	416.185983
ΔH_f, kcal/mol:	-187.07
Dipole, Da:	2.49
IP(EA), eV:	-9.18(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(cyclopropylmethyl)-6-(2-fluoro-4-methoxyphenyl)-N-(1-hydroxypropan-2-yl)-8-oxo-1,8a-dihydroimidazo[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

C1COCCN1C(=O)C2CNC(NC2=O)COC3=CC=C(C=C3)F

DOS

IR

Vibrations