Geometry & MOs

Info

ID:	396461
PubChem CID:	135028465
Reduced:	NO5C22H37 (1)
Stoich.:	AB5C22D37 (1)
Weight, g/mol:	354.186251
ΔH_f, kcal/mol:	-256.86
Dipole, Da:	3.38
IP(EA), eV:	-9.3(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 2-[(2E)-4-[tert-butyl(dimethyl)silyl]oxypenta-2,4-dienyl]cyclopropane-1,1-dicarboxylate

Drug info:

PubChemData

Smile

C[C@H]1[C@@H](O[C@]2(CCC1O2)C)[C@H](C)[C@@H]([C@H](C)[C@H]([C@@H](C)/C=C/C=C(/C)\C(=O)N)O)O

DOS

IR

Vibrations