Geometry & MOs

Info

ID:	74486
PubChem CID:	48421943
Reduced:	NSO4C11H19 (1)
Stoich.:	ABC4D11E19 (1)
Weight, g/mol:	368.184841
ΔH_f, kcal/mol:	-170.35
Dipole, Da:	4.99
IP(EA), eV:	-10.15(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-oxo-3-phenyl-1-(4-pyridin-4-ylpiperazin-1-yl)propan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCS(=O)(=O)C1)OCC2CC2

DOS

IR

Vibrations