Geometry & MOs

Info

ID:	193701
PubChem CID:	78426248
Reduced:	OF3N4C17H27 (1)
Stoich.:	AB3C4D17E27 (1)
Weight, g/mol:	548.142675
ΔH_f, kcal/mol:	-186.6
Dipole, Da:	4.93
IP(EA), eV:	-8.66(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[(4-chloro-2-fluorophenyl)methyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)-6-(3-fluoroazetidine-1-carbonyl)carbazole-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)CCCCNCC1=NC=CC(=C1)CNC(=O)C(F)(F)F

DOS

IR

Vibrations