Geometry & MOs

Info

ID:	213249
PubChem CID:	81063263
Reduced:	ClNSO3C12H18 (1)
Stoich.:	ABCD3E12F18 (1)
Weight, g/mol:	322.111791
ΔH_f, kcal/mol:	-117.51
Dipole, Da:	6.42
IP(EA), eV:	-9.6(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(chloromethyl)-1-ethyl-N-methyl-N-(2-propan-2-yloxyethyl)pyrrole-3-sulfonamide

Drug info:

PubChemData

Smile

CCOCCN(C)S(=O)(=O)C1=CC=C(C=C1)CCl

DOS

IR

Vibrations