Geometry & MOs

Info

ID:	331888
PubChem CID:	127250174
Reduced:	SN3O3C24H27 (1)
Stoich.:	AB3C3D24E27 (1)
Weight, g/mol:	382.144119
ΔH_f, kcal/mol:	-58.43
Dipole, Da:	4.49
IP(EA), eV:	-8.86(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[5-[(4-fluorophenyl)methyl]pyridin-2-yl]morpholin-4-yl]-(4-methyl-1,2,5-oxadiazol-3-yl)methanone

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1CC2=CN=C(C=C2)C3CN(CCO3)C(=O)C4=C(N=C(S4)C)C

DOS

IR

Vibrations