Geometry & MOs

Info

ID:	346170
PubChem CID:	127270658
Reduced:	SO3N4C19H30 (1)
Stoich.:	AB3C4D19E30 (1)
Weight, g/mol:	380.188212
ΔH_f, kcal/mol:	-90.76
Dipole, Da:	4.51
IP(EA), eV:	-8.75(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(benzenesulfonyl)-N-[2-[cyclopropyl(ethyl)amino]ethyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCN(CCNC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C)C3CC3

DOS

IR

Vibrations