Geometry & MOs

Info

ID:	337601
PubChem CID:	127258224
Reduced:	BClNO2C10H11 (1)
Stoich.:	ABCD2E10F11 (1)
Weight, g/mol:	218.133821
ΔH_f, kcal/mol:	-154.96
Dipole, Da:	5.8
IP(EA), eV:	-8.46(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[ethoxy(dimethyl)silyl]ethyl butanoate

Drug info:

PubChemData

Smile

B(C1=CC2=C(C=C1)C=C(C=C2)N)(O)O.Cl

DOS

IR

Vibrations