Geometry & MOs

Info

ID:	332748
PubChem CID:	127251058
Reduced:	O4N5C21H23 (1)
Stoich.:	A4B5C21D23 (1)
Weight, g/mol:	425.186318
ΔH_f, kcal/mol:	-41.39
Dipole, Da:	3.94
IP(EA), eV:	-9.0(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(dimethylamino)methyl]-5-methyl-1,2-oxazol-3-yl]-[2-[6-(2-fluorophenyl)pyrazin-2-yl]morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CCC(=O)N2CCOC(C2)C3=NC(=CN=C3)C4=CC(=CC=C4)OC

DOS

IR

Vibrations