Geometry & MOs

Info

ID:	171771
PubChem CID:	75424679
Reduced:	SN3O5C20H25 (1)
Stoich.:	AB3C5D20E25 (1)
Weight, g/mol:	370.06551
ΔH_f, kcal/mol:	-173.37
Dipole, Da:	4.61
IP(EA), eV:	-8.42(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(6-chlorobenzotriazol-1-yl)oxymethyl]-2-(2-phenylethyl)-1,3-thiazole

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(SC2=C1CCN(C2)CC(=O)NC3=C(C=CC(=C3)OC)OC)N

DOS

IR

Vibrations