Geometry & MOs

Info

ID:	354434
PubChem CID:	127286878
Reduced:	SO3N4C19H30 (1)
Stoich.:	AB3C4D19E30 (1)
Weight, g/mol:	372.216141
ΔH_f, kcal/mol:	-99.45
Dipole, Da:	4.95
IP(EA), eV:	-8.92(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclopropyl-N-[[3-(oxolane-2-carbonylamino)phenyl]methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)NS(=O)(=O)CC1=CC=C(C=C1)CNC(=O)N2CCN(CC2)C3CC3

DOS

IR

Vibrations