Geometry & MOs

Info

ID:	42947
PubChem CID:	10317336
Reduced:	N3O3H21C22 (1)
Stoich.:	A3B3C21D22 (1)
Weight, g/mol:	375.092915
ΔH_f, kcal/mol:	-23.64
Dipole, Da:	9.22
IP(EA), eV:	-9.09(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(benzenesulfonyl)indol-2-yl]-(3-methylphenyl)methanone

Drug info:

PubChemData

Smile

C1COCCN1CC2=C3CC4=C(C3=CC=C2)NN=C4C5=CC=C(C=C5)C(=O)O

DOS

IR

Vibrations