Geometry & MOs

Info

ID:	299767
PubChem CID:	117689258
Reduced:	O4N5H19C22 (1)
Stoich.:	A4B5C19D22 (1)
Weight, g/mol:	386.303224
ΔH_f, kcal/mol:	2.7
Dipole, Da:	8.65
IP(EA), eV:	-9.25(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-butoxy-1-[2-butoxy-1-(3-ethyloxetan-3-yl)ethoxy]ethyl]-3-ethyloxetane

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)C(=O)C2=C3C(=CC(=C2)C4=C(ON=C4C)C)N(C(=N3)C5CC5)C(=O)O

DOS

IR

Vibrations