Geometry & MOs

Info

ID:	291493
PubChem CID:	112835123
Reduced:	BrN2O2S2H19C23 (1)
Stoich.:	AB2C2D2E19F23 (1)
Weight, g/mol:	382.090662
ΔH_f, kcal/mol:	-2.46
Dipole, Da:	4.21
IP(EA), eV:	-8.68(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-[[5-(3-chlorophenyl)thiophen-2-yl]methylamino]-2,3-dihydroindol-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CSC(S1)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)Br

DOS

IR

Vibrations