Geometry & MOs

Info

ID:	146608
PubChem CID:	53715977
Reduced:	NOC19H23 (1)
Stoich.:	ABC19D23 (1)
Weight, g/mol:	281.177964
ΔH_f, kcal/mol:	-9.94
Dipole, Da:	2.22
IP(EA), eV:	-8.57(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=CC2=C(CCC[C@H](C2)NCC3=CC=CC=C3)C=C1

DOS

IR

Vibrations