Geometry & MOs

Info

ID:	232069
PubChem CID:	87575367
Reduced:	SN3O6C23H25 (1)
Stoich.:	AB3C6D23E25 (1)
Weight, g/mol:	206.95872
ΔH_f, kcal/mol:	-207.79
Dipole, Da:	3.8
IP(EA), eV:	-8.97(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzoselenophene-4-carbonitrile

Drug info:

PubChemData

Smile

CCOC(=O)CCC1=C(NC2=C1C(=O)CCC2)/C=C/3\C4=C(C=CC(=C4)S(=O)(=O)NC)NC3=O

DOS

IR

Vibrations