Geometry & MOs

Info

ID:	244330
PubChem CID:	99344066
Reduced:	SN4O4H16C23 (1)
Stoich.:	AB4C4D16E23 (1)
Weight, g/mol:	477.147075
ΔH_f, kcal/mol:	-5.32
Dipole, Da:	4.61
IP(EA), eV:	-8.97(-2.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-methoxyphenyl)sulfamoyl]-4-methyl-N-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]benzamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)C3=C(S2(=O)=O)C=C(C=C3)C(=O)NC4=CN(N=C4)CC5=CC=NC=C5

DOS

IR

Vibrations