Geometry & MOs

Info

ID:	163402
PubChem CID:	57935792
Reduced:	N3O3C30H43 (1)
Stoich.:	A3B3C30D43 (1)
Weight, g/mol:	447.022659
ΔH_f, kcal/mol:	-109.0
Dipole, Da:	5.37
IP(EA), eV:	-8.2(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(7-chloroindol-1-yl)-N-[4-(1,2,4-thiadiazol-5-ylsulfamoyl)phenyl]acetamide

Drug info:

PubChemData

Smile

CC1CCCCN1CCCOC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC(=C(C=C4)OC)C(C)C

DOS

IR

Vibrations