Geometry & MOs

Info

ID:	154631
PubChem CID:	56314110
Reduced:	FO2N5H18C23 (1)
Stoich.:	AB2C5D18E23 (1)
Weight, g/mol:	419.072196
ΔH_f, kcal/mol:	39.18
Dipole, Da:	4.98
IP(EA), eV:	-9.36(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(4-methoxypyrimidin-2-yl)amino]carbamoyl]-N-(4-methylphenyl)thiophene-3-sulfonamide

Drug info:

PubChemData

Smile

C1=CC(=CN=C1)OC2=C(C=C(C=C2)/C=C/C(=O)NCC3=CC(=NC=C3)N4C=CC=N4)F

DOS

IR

Vibrations