Geometry & MOs

Info

ID:	343359
PubChem CID:	127266532
Reduced:	ClNS2O3C14H20 (1)
Stoich.:	ABC2D3E14F20 (1)
Weight, g/mol:	302.126657
ΔH_f, kcal/mol:	-113.12
Dipole, Da:	6.47
IP(EA), eV:	-9.06(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-5-[2-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]ethenyl]phenol

Drug info:

PubChemData

Smile

CC(C)(C)N(CCS(=O)(=O)C)C(=O)C=CC1=CC=C(S1)Cl

DOS

IR

Vibrations