Geometry & MOs

Info

ID:	268295
PubChem CID:	103598781
Reduced:	SN2O3C18H22 (1)
Stoich.:	AB2C3D18E22 (1)
Weight, g/mol:	346.200491
ΔH_f, kcal/mol:	-58.94
Dipole, Da:	3.91
IP(EA), eV:	-8.35(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[[5-(4-butoxyphenyl)-1,3,4-oxadiazol-2-yl]methoxy]-3-methylbutanimidamide

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)C=CC(=O)N(C)CC2=CSC(=N2)C)OC

DOS

IR

Vibrations