Geometry & MOs

Info

ID:	389688
PubChem CID:	134994451
Reduced:	TeO2Cl4C9H14 (1)
Stoich.:	AB2C4D9E14 (1)
Weight, g/mol:	255.110673
ΔH_f, kcal/mol:	-177.88
Dipole, Da:	4.07
IP(EA), eV:	-9.75(-2.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(furan-2-yl)-2-nitroheptanoate

Drug info:

PubChemData

Smile

CC[C@H]([C@H](C[Te](Cl)(Cl)Cl)OC(=O)/C=C/C)Cl

DOS

IR

Vibrations