Geometry & MOs

Info

ID:	205925
PubChem CID:	80178355
Reduced:	SN2O3C15H24 (1)
Stoich.:	AB2C3D15E24 (1)
Weight, g/mol:	310.171499
ΔH_f, kcal/mol:	-117.94
Dipole, Da:	4.51
IP(EA), eV:	-8.44(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,3-diethylpyrrolidin-1-yl)sulfonyl-4-ethylaniline

Drug info:

PubChemData

Smile

CCC1(CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)N)OC)CC

DOS

IR

Vibrations