Geometry & MOs

Info

ID:	369423
PubChem CID:	127333360
Reduced:	O2N3C16H21 (1)
Stoich.:	A2B3C16D21 (1)
Weight, g/mol:	259.168462
ΔH_f, kcal/mol:	-64.06
Dipole, Da:	2.87
IP(EA), eV:	-8.74(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydroindol-1-yl-(2,4-dimethylpiperazin-1-yl)methanone

Drug info:

PubChemData

Smile

CN(C)C(=O)C1CCCN1C(=O)N2CCC3=CC=CC=C32

DOS

IR

Vibrations