Geometry & MOs

Info

ID:	79682
PubChem CID:	49829965
Reduced:	FN4O4H19C22 (1)
Stoich.:	AB4C4D19E22 (1)
Weight, g/mol:	410.163043
ΔH_f, kcal/mol:	-158.6
Dipole, Da:	3.63
IP(EA), eV:	-9.38(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11-(furan-2-carbonyl)-3-naphthalen-2-yl-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CN2C(=O)C3C(N[C@]4(C3C2=O)C5=C(C=CC(=C5)F)NC4=O)CC(=O)N

DOS

IR

Vibrations