Geometry & MOs

Info

ID:	122659
PubChem CID:	50816350
Reduced:	SO3N5C23H25 (1)
Stoich.:	AB3C5D23E25 (1)
Weight, g/mol:	400.156912
ΔH_f, kcal/mol:	-31.32
Dipole, Da:	2.05
IP(EA), eV:	-8.32(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[1-(cyclobutanecarbonyl)piperidin-4-yl]-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)NC(=O)N2CCC(CC2)C3=NN=C(S3)C(=O)NC4=CC=CC=C4

DOS

IR

Vibrations