Geometry & MOs

Info

ID:	407532
PubChem CID:	135080279
Reduced:	NSC11H13 (1)
Stoich.:	ABC11D13 (1)
Weight, g/mol:	250.133396
ΔH_f, kcal/mol:	35.69
Dipole, Da:	3.95
IP(EA), eV:	-9.45(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(S)-cyclohexyl(diethoxyphosphoryl)methanol

Drug info:

PubChemData

Smile

C1CCC(CC1)C2=C(C=CS2)C#N

DOS

IR

Vibrations