Geometry & MOs

Info

ID:	151648
PubChem CID:	56260955
Reduced:	N2O4C25H28 (1)
Stoich.:	A2B4C25D28 (1)
Weight, g/mol:	366.157957
ΔH_f, kcal/mol:	-74.74
Dipole, Da:	3.58
IP(EA), eV:	-8.68(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[2-oxo-2-[2-(4-prop-2-ynoxyphenyl)ethylamino]ethoxy]phenyl]acetamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1C(=O)N2CCCC2C(=O)NCCC3=CC=C(C=C3)OCC#C

DOS

IR

Vibrations