Geometry & MOs

Info

ID:	352121
PubChem CID:	127283189
Reduced:	N3O3C20H27 (1)
Stoich.:	A3B3C20D27 (1)
Weight, g/mol:	258.136828
ΔH_f, kcal/mol:	-86.44
Dipole, Da:	3.51
IP(EA), eV:	-8.88(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclopropylamino)-2-oxoethyl]-2,3-dihydro-1H-indene-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NC2=C(C=C1)OC(=C2)C(=O)NCC3(CCCCC3)N4CCOCC4

DOS

IR

Vibrations