Geometry & MOs

Info

ID:	379074
PubChem CID:	134352262
Reduced:	F2N2O3H12C18 (1)
Stoich.:	A2B2C3D12E18 (1)
Weight, g/mol:	296.096106
ΔH_f, kcal/mol:	-141.93
Dipole, Da:	10.45
IP(EA), eV:	-8.24(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-11-fluoro-10,15-dimethyl-8-oxa-1-azatetracyclo[7.7.1.02,7.013,17]heptadeca-2(7),3,5,9(17),10,12,15-heptaen-14-one

Drug info:

PubChemData

Smile

CC1=CN2C3=C(C=C(C=C3)NC(=O)C)OC4=C2C(=CC(=C4F)F)C1=O

DOS

IR

Vibrations