Geometry & MOs

Info

ID:	288731
PubChem CID:	104324575
Reduced:	N2O3C15H18 (1)
Stoich.:	A2B3C15D18 (1)
Weight, g/mol:	272.116092
ΔH_f, kcal/mol:	-53.84
Dipole, Da:	5.47
IP(EA), eV:	-9.22(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(cyclopropylamino)-2-hydroxypropoxy]-1-benzofuran-2-carbonitrile

Drug info:

PubChemData

Smile

CC(C)NCC(COC1=C(OC2=CC=CC=C21)C#N)O

DOS

IR

Vibrations