Geometry & MOs

Info

ID:	56680
PubChem CID:	21317894
Reduced:	NPSO4C8H10 (1)
Stoich.:	ABCD4E8F10 (1)
Weight, g/mol:	275.038116
ΔH_f, kcal/mol:	-183.26
Dipole, Da:	4.47
IP(EA), eV:	-9.27(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-cyano-5-propylthiophen-3-yl) dimethyl phosphate

Drug info:

PubChemData

Smile

CC1=CC(=C(S1)C#N)OP(=O)(OC)OC

DOS

IR

Vibrations