Geometry & MOs

Info

ID:	153183
PubChem CID:	56312335
Reduced:	N4O4C25H30 (1)
Stoich.:	A4B4C25D30 (1)
Weight, g/mol:	486.193691
ΔH_f, kcal/mol:	-108.64
Dipole, Da:	0.99
IP(EA), eV:	-8.67(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[3-methyl-4-[2-(2-methyl-5-sulfamoyl-2,3-dihydroindol-1-yl)-2-oxoethyl]piperazin-1-yl]benzoate

Drug info:

PubChemData

Smile

CC1CN(CCN1CC(=O)NC2=CC=CC(=C2)C(=O)NC3CC3)C4=CC=C(C=C4)C(=O)OC

DOS

IR

Vibrations