Geometry & MOs

Info

ID:	353053
PubChem CID:	127284203
Reduced:	O3N4C19H28 (1)
Stoich.:	A3B4C19D28 (1)
Weight, g/mol:	315.194677
ΔH_f, kcal/mol:	-106.29
Dipole, Da:	3.04
IP(EA), eV:	-8.44(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-acetylpiperazin-1-yl)ethyl]-2,3-dihydro-1H-indene-1-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1CCN(CC1)CCNC(=O)C2=CC=CC=C2N3CCOCC3

DOS

IR

Vibrations