Geometry & MOs

Info

ID:	222556
PubChem CID:	85305515
Reduced:	ON3H23C24 (1)
Stoich.:	AB3C23D24 (1)
Weight, g/mol:	369.071802
ΔH_f, kcal/mol:	68.14
Dipole, Da:	4.03
IP(EA), eV:	-8.48(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-methylphenyl)methylideneamino]-2-[(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide

Drug info:

PubChemData

Smile

CN1C(=O)C(N(C(=N1)C2=CC=CC=C2)CC3=CC=CC=C3)CC4=CC=CC=C4

DOS

IR

Vibrations