Geometry & MOs

Info

ID:	225744
PubChem CID:	87225785
Reduced:	N2O3C27H40 (1)
Stoich.:	A2B3C27D40 (1)
Weight, g/mol:	410.256943
ΔH_f, kcal/mol:	-107.95
Dipole, Da:	3.93
IP(EA), eV:	-8.52(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-7-(naphthalen-1-yloxymethyl)-8-(2-pyrrolidin-1-ylethylamino)oct-6-enoic acid

Drug info:

PubChemData

Smile

CC(CCC/C=C(/CNCC(C)(C)CN(C)C)\COC1=CC=CC2=CC=CC=C21)C(=O)O

DOS

IR

Vibrations