Geometry & MOs

Info

ID:	143114
PubChem CID:	53149087
Reduced:	OF2N3C19H21 (1)
Stoich.:	AB2C3D19E21 (1)
Weight, g/mol:	368.078851
ΔH_f, kcal/mol:	-89.82
Dipole, Da:	7.0
IP(EA), eV:	-8.51(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-chlorophenyl)methyl]-2-(7-oxo-2,4,5,8,13-pentazatricyclo[7.4.0.02,6]trideca-1(9),3,5,10,12-pentaen-8-yl)acetamide

Drug info:

PubChemData

Smile

C1CCCN(CC1)C2=NC=C(C=C2)CNC(=O)C3=CC(=C(C=C3)F)F

DOS

IR

Vibrations