Geometry & MOs

Info

ID:	122973
PubChem CID:	50829328
Reduced:	SN4O5C24H24 (1)
Stoich.:	AB4C5D24E24 (1)
Weight, g/mol:	469.167142
ΔH_f, kcal/mol:	-113.36
Dipole, Da:	5.94
IP(EA), eV:	-9.32(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[3-[(3,4-dimethylphenyl)sulfonylamino]phenoxy]-N-(3-methoxypropyl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)C)S(=O)(=O)NC2=CC(=CC=C2)OC3=NC=C(C=C3)C(=O)NCC=C

DOS

IR

Vibrations