Geometry & MOs

Info

ID:	73633
PubChem CID:	48419551
Reduced:	ClSN3O5H16C17 (1)
Stoich.:	ABC3D5E16F17 (1)
Weight, g/mol:	369.124405
ΔH_f, kcal/mol:	-78.76
Dipole, Da:	9.33
IP(EA), eV:	-9.64(-1.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[2-[[2-(1-methylindol-3-yl)acetyl]amino]ethyl]benzamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)NCCNC(=O)CS(=O)C2=CC=C(C=C2)[N+](=O)[O-])Cl

DOS

IR

Vibrations