Geometry & MOs

Info

ID:	422959
PubChem CID:	135118686
Reduced:	N3O3C23H29 (1)
Stoich.:	A3B3C23D29 (1)
Weight, g/mol:	347.141596
ΔH_f, kcal/mol:	-58.45
Dipole, Da:	5.29
IP(EA), eV:	-8.61(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl(2-pyridin-2-ylethyl)amino]-N-[5-(oxolan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=C(C(=NO2)N3CCCC3)C(=O)N4CCC5(C4)CCCC5

DOS

IR

Vibrations