Geometry & MOs

Info

ID:	411149
PubChem CID:	135083959
Reduced:	NO4C10H11 (1)
Stoich.:	AB4C10D11 (1)
Weight, g/mol:	164.029586
ΔH_f, kcal/mol:	-94.7
Dipole, Da:	2.63
IP(EA), eV:	-8.54(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxyethynylsulfanylbenzene

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)N(C(=O)CO2)OC

DOS

IR

Vibrations