Geometry & MOs

Info

ID:	184715
PubChem CID:	77196073
Reduced:	SN2O4C27H28 (1)
Stoich.:	AB2C4D27E28 (1)
Weight, g/mol:	477.208613
ΔH_f, kcal/mol:	-95.99
Dipole, Da:	6.53
IP(EA), eV:	-8.42(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-aminophenyl)ethyl]-1-(4-tert-butylphenyl)sulfonyl-2,3-dihydroindole-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2C(CC3=CC=CC=C32)C(=O)NCC(=O)C4=CC=CC=C4

DOS

IR

Vibrations