Geometry & MOs

Info

ID:	200186
PubChem CID:	79359535
Reduced:	ClNSO3C15H22 (1)
Stoich.:	ABCD3E15F22 (1)
Weight, g/mol:	314.166414
ΔH_f, kcal/mol:	-115.95
Dipole, Da:	5.53
IP(EA), eV:	-9.65(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-5-(hydroxymethyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrrole-3-sulfonamide

Drug info:

PubChemData

Smile

CC1(C(C1(C)C)CNS(=O)(=O)C2=C(C=CC(=C2)CO)Cl)C

DOS

IR

Vibrations