Geometry & MOs

Info

ID:	320450
PubChem CID:	126661116
Reduced:	NC15H19 (1)
Stoich.:	AB15C19 (1)
Weight, g/mol:	360.163791
ΔH_f, kcal/mol:	75.87
Dipole, Da:	2.31
IP(EA), eV:	-7.77(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E)-12-(3-fluorophenyl)-3-methyl-10-methylidene-4-oxo-5-azabicyclo[9.4.0]pentadeca-1(11),2,12,14-tetraene-14-carbonitrile

Drug info:

PubChemData

Smile

CCC(=C)NC1=CC=C(C=CC=CC=C1)C

DOS

IR

Vibrations