Geometry & MOs

Info

ID:	393239
PubChem CID:	135019833
Reduced:	NO4C9H14 (2)
Stoich.:	AB4C9D14 (2)
Weight, g/mol:	210.107836
ΔH_f, kcal/mol:	-356.83
Dipole, Da:	1.68
IP(EA), eV:	-9.7(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-thiophen-2-yloctanal

Drug info:

PubChemData

Smile

CCOC(=O)C(=CNCCNC=C(C(=O)OCC)C(=O)OCC)C(=O)OCC

DOS

IR

Vibrations