Geometry & MOs

Info

ID:	283460
PubChem CID:	103983631
Reduced:	NC13H17 (1)
Stoich.:	AB13C17 (1)
Weight, g/mol:	227.1674
ΔH_f, kcal/mol:	22.31
Dipole, Da:	0.85
IP(EA), eV:	-8.98(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z)-4-(2,3-dihydro-1H-inden-5-ylmethylidene)azepane

Drug info:

PubChemData

Smile

C1C/C(=C\C2=CC=CC=C2)/CCNC1

DOS

IR

Vibrations