Geometry & MOs

Info

ID:	222389
PubChem CID:	85297340
Reduced:	NO7H17C23 (1)
Stoich.:	AB7C17D23 (1)
Weight, g/mol:	419.312347
ΔH_f, kcal/mol:	-212.56
Dipole, Da:	3.2
IP(EA), eV:	-9.76(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[3-(1-azacyclopentadec-10-en-1-yl)propylamino]propyl]-2,2,2-trifluoroacetamide

Drug info:

PubChemData

Smile

COC(=O)C(CC1=CC2=C(C3=CC=CC=C3OC2=O)OC1=O)NC(=O)C4=CC=CC=C4

DOS

IR

Vibrations