Geometry & MOs

Info

ID:	145768
PubChem CID:	53590683
Reduced:	O3N5C17H27 (1)
Stoich.:	A3B5C17D27 (1)
Weight, g/mol:	342.116877
ΔH_f, kcal/mol:	-95.74
Dipole, Da:	2.76
IP(EA), eV:	-9.36(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-chlorophenyl)methyl]-1,1-dioxo-4-piperidin-1-ylthiolan-3-amine

Drug info:

PubChemData

Smile

C1CCCN(CC1)C(=O)CN2C=NC(=N2)NC(=O)COC3CCCC3

DOS

IR

Vibrations