Geometry & MOs

Info

ID:	293747
PubChem CID:	117399420
Reduced:	O3C16H18 (1)
Stoich.:	A3B16C18 (1)
Weight, g/mol:	258.136828
ΔH_f, kcal/mol:	-71.09
Dipole, Da:	3.5
IP(EA), eV:	-8.48(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-2-yl)-1,2-oxazol-3-amine

Drug info:

PubChemData

Smile

COC1=CC=CC2=C1C=CC(=C2OC)CC3(CC3)O

DOS

IR

Vibrations