Geometry & MOs

Info

ID:	152635
PubChem CID:	56311639
Reduced:	O2N5C25H29 (1)
Stoich.:	A2B5C25D29 (1)
Weight, g/mol:	456.183127
ΔH_f, kcal/mol:	1.0
Dipole, Da:	6.17
IP(EA), eV:	-8.89(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]acetyl]-2,3-dihydroindole-5-sulfonamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(=O)N2CCN(CC2)CC(=O)NC3=CC=NN3CC4=CC=CC=C4

DOS

IR

Vibrations