Geometry & MOs

Info

ID:	325994
PubChem CID:	126685931
Reduced:	IN2O2C8H15 (1)
Stoich.:	AB2C2D8E15 (1)
Weight, g/mol:	278.115424
ΔH_f, kcal/mol:	-75.77
Dipole, Da:	3.86
IP(EA), eV:	-8.83(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(2-methoxy-2-oxoethyl)phenyl]methyl 4-oxopentanoate

Drug info:

PubChemData

Smile

C1COCCN1CCNC(=O)CI

DOS

IR

Vibrations