Geometry & MOs

Info

ID:	195438
PubChem CID:	78685626
Reduced:	N3O4H21C23 (1)
Stoich.:	A3B4C21D23 (1)
Weight, g/mol:	413.140927
ΔH_f, kcal/mol:	-75.38
Dipole, Da:	4.73
IP(EA), eV:	-8.76(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(2,6-dimethylphenyl)propanamide

Drug info:

PubChemData

Smile

CC(C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)OC(=O)C=CC3=CC=C(C=C3)C#N

DOS

IR

Vibrations