Geometry & MOs

Info

ID:	171911
PubChem CID:	75439952
Reduced:	ON3C16H19 (1)
Stoich.:	AB3C16D19 (1)
Weight, g/mol:	350.141262
ΔH_f, kcal/mol:	7.58
Dipole, Da:	3.09
IP(EA), eV:	-9.21(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[[(2S)-2,3-dihydroxypropyl]-methylamino]methyl]-N-(4-ethylphenyl)-1,3,4-thiadiazole-2-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC=CC=N1)N(CC2=CC=CC=C2)CC(=O)N

DOS

IR

Vibrations