Geometry & MOs

Info

ID:	262741
PubChem CID:	103313321
Reduced:	NOC8H11 (2)
Stoich.:	ABC8D11 (2)
Weight, g/mol:	272.152478
ΔH_f, kcal/mol:	-76.77
Dipole, Da:	4.84
IP(EA), eV:	-9.1(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(7-oxabicyclo[2.2.1]heptan-2-ylamino)-1,3,4,5-tetrahydro-1-benzazepin-2-one

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2NC(=O)C1NCC3CCOCC3

DOS

IR

Vibrations