Geometry & MOs

Info

ID:	439199
PubChem CID:	135228964
Reduced:	NS2H15C22 (1)
Stoich.:	AB2C15D22 (1)
Weight, g/mol:	262.133396
ΔH_f, kcal/mol:	115.62
Dipole, Da:	1.05
IP(EA), eV:	-7.98(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-dimethoxyphosphoryl-1-(4-ethylidenecyclohexyl)ethanol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(C2=CC3=C(C=C2)SC=C3)C4=CC5=C(C=C4)SC=C5

DOS

IR

Vibrations