Geometry & MOs

Info

ID:	446873
PubChem CID:	135278385
Reduced:	N2O5C28H38 (1)
Stoich.:	A2B5C28D38 (1)
Weight, g/mol:	399.204573
ΔH_f, kcal/mol:	-172.23
Dipole, Da:	5.04
IP(EA), eV:	-8.5(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-[2-(4-phenylmethoxyphenoxy)ethoxy]azetidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC(CC1)N2CC(C2)OCCOC3=CC=C(C=C3)OCC4=CC=CC=C4

DOS

IR

Vibrations