Geometry & MOs

Info

ID:	146607
PubChem CID:	53715976
Reduced:	NO2C22H29 (1)
Stoich.:	AB2C22D29 (1)
Weight, g/mol:	281.177964
ΔH_f, kcal/mol:	-71.05
Dipole, Da:	3.32
IP(EA), eV:	-9.12(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6R)-N-benzyl-3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-amine

Drug info:

PubChemData

Smile

CCCCCCCC=CC1=NC2=CC=CC=C2C(=C1CC)OC(=O)C

DOS

IR

Vibrations