Geometry & MOs

Info

ID:	232084
PubChem CID:	87575413
Reduced:	ClNO3C19H20 (1)
Stoich.:	ABC3D19E20 (1)
Weight, g/mol:	275.93594
ΔH_f, kcal/mol:	-75.07
Dipole, Da:	3.14
IP(EA), eV:	-9.16(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-benzoselenophene-4-sulfonate

Drug info:

PubChemData

Smile

C1COCCC1OC2=CC=C(C=C2)C(C=O)(C3=CC=C(C=C3)Cl)N

DOS

IR

Vibrations