Geometry & MOs

Info

ID:	359744
PubChem CID:	127299691
Reduced:	SN3O3C20H25 (1)
Stoich.:	AB3C3D20E25 (1)
Weight, g/mol:	389.185175
ΔH_f, kcal/mol:	-101.2
Dipole, Da:	5.05
IP(EA), eV:	-8.68(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydroindol-1-yl)-2-[4-(imidazo[1,2-a]pyridine-6-carbonyl)piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)CCC(=O)N2CCSC3=CC=CC=C32)C(=O)NC4CC4

DOS

IR

Vibrations