Geometry & MOs

Info

ID:	36693
PubChem CID:	8011327
Reduced:	NO3C7H9 (2)
Stoich.:	AB3C7D9 (2)
Weight, g/mol:	351.104148
ΔH_f, kcal/mol:	-225.3
Dipole, Da:	3.79
IP(EA), eV:	-8.61(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC(=O)NC)OC(=O)C1=CC(=C(C=C1)OC)OC

DOS

IR

Vibrations