Geometry & MOs

Info

ID:	278410
PubChem CID:	103835435
Reduced:	ClNSO4C14H22 (1)
Stoich.:	ABCD4E14F22 (1)
Weight, g/mol:	311.155515
ΔH_f, kcal/mol:	-182.32
Dipole, Da:	3.4
IP(EA), eV:	-9.72(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4,4-dimethylpentyl)-2,3-dihydro-1H-indene-5-sulfonamide

Drug info:

PubChemData

Smile

CC(C)(C)CC(CNS(=O)(=O)C1=C(C=C(C=C1)Cl)OC)O

DOS

IR

Vibrations