Geometry & MOs

Info

ID:	332724
PubChem CID:	127251034
Reduced:	FN4O4C22H25 (1)
Stoich.:	AB4C4D22E25 (1)
Weight, g/mol:	421.21139
ΔH_f, kcal/mol:	-149.92
Dipole, Da:	2.73
IP(EA), eV:	-9.39(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[6-(3-methoxyphenyl)pyrazin-2-yl]morpholin-4-yl]-2-(2-propan-2-ylimidazol-1-yl)ethanone

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)CCOCC(=O)N2CCOC(C2)C3=NC(=CN=C3)C4=CC=CC=C4F

DOS

IR

Vibrations