Geometry & MOs

Info

ID:	394824
PubChem CID:	135023869
Reduced:	INSSiC14H22 (1)
Stoich.:	ABCDE14F22 (1)
Weight, g/mol:	219.089543
ΔH_f, kcal/mol:	-0.51
Dipole, Da:	1.03
IP(EA), eV:	-8.74(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(E)-3-(methylamino)-3-oxoprop-1-enyl]phenyl] acetate

Drug info:

PubChemData

Smile

C[Si](C)(C)C1=CC(=C(S1)C=NC2CCCCC2)I

DOS

IR

Vibrations