Geometry & MOs

Info

ID:	47878
PubChem CID:	10535717
Reduced:	NO2C11H13 (1)
Stoich.:	AB2C11D13 (1)
Weight, g/mol:	191.094629
ΔH_f, kcal/mol:	-2.6
Dipole, Da:	1.52
IP(EA), eV:	-9.43(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methoxy-1,2,3,4-tetrahydro-1-benzazepin-5-one

Drug info:

PubChemData

Smile

CO/N=C(/C1=CC=CC=C1)\C(C=C)O

DOS

IR

Vibrations