Geometry & MOs

Info

ID:	307893
PubChem CID:	125310619
Reduced:	P2N5O15C17H25 (1)
Stoich.:	A2B5C15D17E25 (1)
Weight, g/mol:	214.209679
ΔH_f, kcal/mol:	-716.71
Dipole, Da:	4.56
IP(EA), eV:	-9.07(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,5R)-5-ethyl-5-fluorododec-6-ene

Drug info:

PubChemData

Smile

CC(=O)O[C@@H]1[C@@H](O[C@H]([C@@H]1O)O)COP(=O)(O)OP(=O)(O)OC[C@H]2[C@H]([C@H]([C@H](O2)N3C=NC4=C(N=CN=C43)N)O)O

DOS

IR

Vibrations