Geometry & MOs

Info

ID:	140421
PubChem CID:	52694885
Reduced:	SN2O5C23H26 (1)
Stoich.:	AB2C5D23E26 (1)
Weight, g/mol:	370.135114
ΔH_f, kcal/mol:	-126.4
Dipole, Da:	6.26
IP(EA), eV:	-8.6(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-methylphenoxy)methyl]-5-[(2-propan-2-yloxyphenyl)methylsulfanyl]-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=C(N=C(S1)NC(=O)CCC2=C(C(=C(C=C2)OC)OC)OC)C3=CC=C(C=C3)OC

DOS

IR

Vibrations