Geometry & MOs

Info

ID:	421515
PubChem CID:	135116154
Reduced:	O3N4C19H32 (1)
Stoich.:	A3B4C19D32 (1)
Weight, g/mol:	374.035561
ΔH_f, kcal/mol:	-151.28
Dipole, Da:	0.84
IP(EA), eV:	-9.3(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4aR,6R,7aR)-3-oxo-1,2,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridin-6-yl]-2,3,5-trichloro-N-methylbenzamide

Drug info:

PubChemData

Smile

CC1=C(N=CN1)CN(CCO)C(=O)CCC(=O)NC2CCCCCCC2

DOS

IR

Vibrations