Geometry & MOs

Info

ID:	157202
PubChem CID:	56422391
Reduced:	O2S2N6C17H18 (1)
Stoich.:	A2B2C6D17E18 (1)
Weight, g/mol:	459.988917
ΔH_f, kcal/mol:	29.28
Dipole, Da:	4.8
IP(EA), eV:	-8.91(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-chlorophenoxy)methyl]-N-[2-(1,3,4-thiadiazol-2-ylsulfanyl)phenyl]-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CCC2=NN(C(=O)N2CC1)CC(=O)NC3=CC=CC=C3SC4=NN=CS4

DOS

IR

Vibrations