Geometry & MOs

Info

ID:	163850
PubChem CID:	74380547
Reduced:	N3O3C31H35 (1)
Stoich.:	A3B3C31D35 (1)
Weight, g/mol:	458.360739
ΔH_f, kcal/mol:	-1.67
Dipole, Da:	2.76
IP(EA), eV:	-8.73(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[2-(2-hydroxyethoxy)ethoxy]-11-nonoxyundec-8-enoate

Drug info:

PubChemData

Smile

CN(C)CCCCC(C1=CC=CC=C1)(C(C2=CC=CC=C2)C3=C(N=C4C=CC(=CC4=C3)C=NO)OC)O

DOS

IR

Vibrations