Geometry & MOs

Info

ID:	9859
PubChem CID:	94018
Reduced:	NC17H19 (1)
Stoich.:	AB17C19 (1)
Weight, g/mol:	237.15175
ΔH_f, kcal/mol:	38.74
Dipole, Da:	1.3
IP(EA), eV:	-8.6(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-propyl-5,7-dihydrobenzo[d][2]benzazepine

Drug info:

PubChemData

Smile

CCCN1CC2=CC=CC=C2C3=CC=CC=C3C1

DOS

IR

Vibrations