Geometry & MOs

Info

ID:	396204
PubChem CID:	135027715
Reduced:	NO6C27H51 (1)
Stoich.:	AB6C27D51 (1)
Weight, g/mol:	316.094688
ΔH_f, kcal/mol:	-372.2
Dipole, Da:	2.09
IP(EA), eV:	-9.56(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (4R)-2-hydroxy-7-methyl-5-oxo-4-phenyl-3,4-dihydropyrano[3,2-c]pyran-2-carboxylate

Drug info:

PubChemData

Smile

CCCCCCC(/C(=C/[C@@H](C)[C@H]([C@H](C(C)C)NC(=O)OC(C)(C)C)O)/C)OC(=O)OC(C)(C)C

DOS

IR

Vibrations