Geometry & MOs

Info

ID:	233711
PubChem CID:	92093018
Reduced:	ON3C22H23 (1)
Stoich.:	AB3C22D23 (1)
Weight, g/mol:	424.156912
ΔH_f, kcal/mol:	28.08
Dipole, Da:	7.84
IP(EA), eV:	-9.78(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(diethylsulfamoyl)-N-[(2-pyridin-4-ylpyridin-3-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)C(=O)NCC2=C(N=CC=C2)C3=CC=NC=C3

DOS

IR

Vibrations