Geometry & MOs

Info

ID:	157108
PubChem CID:	56422141
Reduced:	ON5C24H27 (1)
Stoich.:	AB5C24D27 (1)
Weight, g/mol:	412.182064
ΔH_f, kcal/mol:	61.01
Dipole, Da:	5.7
IP(EA), eV:	-8.6(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1H-indol-5-yl)-N-(4-methylpentan-2-yl)-4-(methylsulfonylmethyl)benzamide

Drug info:

PubChemData

Smile

CC(C)CC(C)N(C1=CC2=C(C=C1)NC=C2)C(=O)C3=CN(N=N3)CC4=CC=CC=C4

DOS

IR

Vibrations