Geometry & MOs

Info

ID:	84505
PubChem CID:	49867042
Reduced:	O4C33H63 (2)
Stoich.:	A4B33C63 (2)
Weight, g/mol:	409.97687
ΔH_f, kcal/mol:	-590.34
Dipole, Da:	3.53
IP(EA), eV:	-9.34(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCC/C=C/CCCCCCCC/C=C/CCCCCCCCCCCCCCCCCCC[C@H]([C@@H](CCCCCCCC)C(=O)OC[C@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O)O)O)O)O

DOS

IR

Vibrations