Geometry & MOs

Info

ID:	294930
PubChem CID:	117505878
Reduced:	FO4C18H23 (1)
Stoich.:	AB4C18D23 (1)
Weight, g/mol:	322.181191
ΔH_f, kcal/mol:	-213.14
Dipole, Da:	4.47
IP(EA), eV:	-8.85(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2-chloro-3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-4-yl)ethyl]piperazine

Drug info:

PubChemData

Smile

CC(C)(C1=CC2=C(C=C1C3(CCCC3)C(=O)O)OCCCO2)F

DOS

IR

Vibrations