Geometry & MOs

Info

ID:	30841
PubChem CID:	841995
Reduced:	OSCl2N3H11C14 (1)
Stoich.:	ABC2D3E11F14 (1)
Weight, g/mol:	305.083413
ΔH_f, kcal/mol:	26.74
Dipole, Da:	2.96
IP(EA), eV:	-8.87(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2,3-dimethoxybenzamide

Drug info:

PubChemData

Smile

CN1C=C(C=N1)CNC(=O)C2=C(C3=C(S2)C=CC=C3Cl)Cl

DOS

IR

Vibrations