Geometry & MOs

Info

ID:	338797
PubChem CID:	127259808
Reduced:	OC11H13 (2)
Stoich.:	AB11C13 (2)
Weight, g/mol:	339.183444
ΔH_f, kcal/mol:	-75.31
Dipole, Da:	2.04
IP(EA), eV:	-9.44(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(1,4-oxazepan-4-yl)-1-phenylethyl] 2-phenylacetate

Drug info:

PubChemData

Smile

CC1(CCC(CC1)(C2=CC=CC=C2)OC(=O)CC3=CC=CC=C3)C

DOS

IR

Vibrations