Geometry & MOs

Info

ID:	343653
PubChem CID:	127266829
Reduced:	NSO2C7H11 (2)
Stoich.:	ABC2D7E11 (2)
Weight, g/mol:	297.078327
ΔH_f, kcal/mol:	-158.88
Dipole, Da:	2.38
IP(EA), eV:	-9.56(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2,4-dihydroxyphenyl)methyl]-1,5-dimethylpyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCC(=O)N=S(=O)(C)C

DOS

IR

Vibrations