Geometry & MOs

Info

ID:	265208
PubChem CID:	103513813
Reduced:	NF2O2C7H9 (1)
Stoich.:	AB2C2D7E9 (1)
Weight, g/mol:	239.075785
ΔH_f, kcal/mol:	-181.04
Dipole, Da:	4.58
IP(EA), eV:	-9.88(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2-difluoroacetyl)-3,4-dihydro-2H-1-benzazepin-5-one

Drug info:

PubChemData

Smile

C1CC(=O)CN(C1)C(=O)C(F)F

DOS

IR

Vibrations