Geometry & MOs

Info

ID:	70394
PubChem CID:	48413285
Reduced:	SN4O4C19H30 (1)
Stoich.:	AB4C4D19E30 (1)
Weight, g/mol:	419.131506
ΔH_f, kcal/mol:	-105.0
Dipole, Da:	3.14
IP(EA), eV:	-8.23(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2,5-dimethoxyphenyl)methyl]-3-fluoro-4-methyl-N-(1-methylpyrazol-4-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

CCCN(CCC)S(=O)(=O)N(CC1=C(C=CC(=C1)OC)OC)C2=CN(N=C2)C

DOS

IR

Vibrations