Geometry & MOs

Info

ID:	382435
PubChem CID:	134973580
Reduced:	O9C34H48 (1)
Stoich.:	A9B34C48 (1)
Weight, g/mol:	414.27701
ΔH_f, kcal/mol:	-319.86
Dipole, Da:	6.62
IP(EA), eV:	-8.57(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E,8E,10E)-7-(methoxymethoxy)-2-methyl-16-phenylmethoxyhexadeca-2,8,10-trienal

Drug info:

PubChemData

Smile

CC=C(COCOC)/C=C/C=C/CCCC[C@@H]1C=C[C@H]2[C@H]([C@]1(C)C(=O)OC3=C(C(=C)OC3=O)OC)CCC[C@@H]2OCOC

DOS

IR

Vibrations