Geometry & MOs

Info

ID:	232520
PubChem CID:	87576354
Reduced:	ClNSF5O6C19H19 (1)
Stoich.:	ABCD5E6F19G19 (1)
Weight, g/mol:	209.95839
ΔH_f, kcal/mol:	-506.01
Dipole, Da:	3.99
IP(EA), eV:	-10.24(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzoselenophene-6-carbaldehyde

Drug info:

PubChemData

Smile

C1CN(CC1(F)F)C(=O)[C@@H]2C[C@H](C[C@H]2C(=O)O)S(=O)(=O)C3=C(C=C(C=C3)OCC(F)(F)F)Cl

DOS

IR

Vibrations