Geometry & MOs

Info

ID:	236977
PubChem CID:	92716588
Reduced:	SO2N5C17H23 (1)
Stoich.:	AB2C5D17E23 (1)
Weight, g/mol:	361.157246
ΔH_f, kcal/mol:	-36.46
Dipole, Da:	2.6
IP(EA), eV:	-9.02(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methyl-2-[(2R)-2-(4-methylpiperidine-1-carbonyl)pyrrolidin-1-yl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

Drug info:

PubChemData

Smile

CC1=CC(=O)N2C(=N1)SC(=N2)N3CCC[C@H]3C(=O)N4CCCCCC4

DOS

IR

Vibrations