Geometry & MOs

Info

ID:	130555
PubChem CID:	51091216
Reduced:	SO3N4C15H20 (1)
Stoich.:	AB3C4D15E20 (1)
Weight, g/mol:	342.055339
ΔH_f, kcal/mol:	-51.3
Dipole, Da:	6.77
IP(EA), eV:	-8.55(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-chloro-5-nitrophenyl)-N-[(5-ethoxy-1,3,4-thiadiazol-2-yl)methyl]-N-methylmethanamine

Drug info:

PubChemData

Smile

CCOC1=NN=C(S1)CN(C)CC(=O)NC2=CC(=CC=C2)OC

DOS

IR

Vibrations