Geometry & MOs

Info

ID:	11455
PubChem CID:	115861
Reduced:	NOC16H17 (1)
Stoich.:	ABC16D17 (1)
Weight, g/mol:	239.131014
ΔH_f, kcal/mol:	2.09
Dipole, Da:	2.98
IP(EA), eV:	-8.88(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5,7-dihydrobenzo[d][2]benzazepin-6-yl)ethanol

Drug info:

PubChemData

Smile

C1C2=CC=CC=C2C3=CC=CC=C3CN1CCO

DOS

IR

Vibrations