Geometry & MOs

Info

ID:	299367
PubChem CID:	117682740
Reduced:	NO4C8H15 (2)
Stoich.:	AB4C8D15 (2)
Weight, g/mol:	397.135718
ΔH_f, kcal/mol:	-362.18
Dipole, Da:	5.61
IP(EA), eV:	-9.91(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[1-(4-chlorophenyl)ethyl]-3-(4-fluorophenyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone

Drug info:

PubChemData

Smile

CC(=O)CCCOC(COC(=O)NCCOC)COC(=O)NCCOC

DOS

IR

Vibrations