Geometry & MOs

Info

ID:	238688
PubChem CID:	92765073
Reduced:	O2N4C25H32 (1)
Stoich.:	A2B4C25D32 (1)
Weight, g/mol:	372.252526
ΔH_f, kcal/mol:	-47.12
Dipole, Da:	3.63
IP(EA), eV:	-8.25(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-acetyl-N-[3-(4-propylpiperazin-1-yl)propyl]-2,3-dihydroindole-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1[C@H](CC2=CC=CC=C21)C(=O)NCCCN3CCN(CC3)CC4=CC=CC=C4

DOS

IR

Vibrations