Geometry & MOs

Info

ID:	332940
PubChem CID:	127251364
Reduced:	O3N6C24H26 (1)
Stoich.:	A3B6C24D26 (1)
Weight, g/mol:	382.121195
ΔH_f, kcal/mol:	-24.78
Dipole, Da:	3.44
IP(EA), eV:	-9.33(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(6-methyl-4-pyrimidin-5-ylpyridin-2-yl)morpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)C2CN(CCO2)C(=O)C3=NNC4=C3CCC4)C5=CN=C(C=C5)C(=O)NC

DOS

IR

Vibrations