Geometry & MOs

Info

ID:	53051
PubChem CID:	14709473
Reduced:	ClNSiO2C7H10 (1)
Stoich.:	ABCD2E7F10 (1)
Weight, g/mol:	277.10791
ΔH_f, kcal/mol:	-96.79
Dipole, Da:	1.82
IP(EA), eV:	-9.71(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-cyano-3-diethoxyphosphorylbutanoate

Drug info:

PubChemData

Smile

C[Si](C)(CCl)OC(=O)C(=C)C#N

DOS

IR

Vibrations