Geometry & MOs

Info

ID:	385659
PubChem CID:	134979656
Reduced:	SN2O7C16H22 (1)
Stoich.:	AB2C7D16E22 (1)
Weight, g/mol:	234.034799
ΔH_f, kcal/mol:	-222.4
Dipole, Da:	0.91
IP(EA), eV:	-9.73(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[[(1R,2R)-2-acetyloxycyclohex-3-en-1-yl]-methoxymethylidene]chromium

Drug info:

PubChemData

Smile

CS(=O)(=O)N([C@@H]1C=CCC[C@H]1C=O)N(C(=O)OCC=C)C(=O)OCC=C

DOS

IR

Vibrations