Geometry & MOs

Info

ID:	322826
PubChem CID:	126671273
Reduced:	NO3C12H17 (1)
Stoich.:	AB3C12D17 (1)
Weight, g/mol:	281.162708
ΔH_f, kcal/mol:	-101.38
Dipole, Da:	3.91
IP(EA), eV:	-8.44(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[2-[3-(methylamino)phenoxy]ethoxy]propoxy]propan-2-one

Drug info:

PubChemData

Smile

CC(=O)COCCOC1=CC=CC(=C1)NC

DOS

IR

Vibrations