Geometry & MOs

Info

ID:	362702
PubChem CID:	127309136
Reduced:	FON5C18H20 (1)
Stoich.:	ABC5D18E20 (1)
Weight, g/mol:	360.135304
ΔH_f, kcal/mol:	-3.47
Dipole, Da:	8.15
IP(EA), eV:	-9.66(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-chloro-2,3-dihydro-1H-inden-1-yl)-2-(pyrazol-1-ylmethyl)morpholine-4-carboxamide

Drug info:

PubChemData

Smile

C1CC1C2=NN=C3N2CCN(C3)C(=O)NC4CCC5=C4C=CC=C5F

DOS

IR

Vibrations