Geometry & MOs

Info

ID:	147431
PubChem CID:	53787087
Reduced:	ClON4C11H15 (1)
Stoich.:	ABC4D11E15 (1)
Weight, g/mol:	373.220578
ΔH_f, kcal/mol:	-21.98
Dipole, Da:	1.85
IP(EA), eV:	-9.44(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2S)-1-[(4-fluorophenyl)methyl]-N-(3-phenylpropyl)-1,2,3,4-tetrahydronaphthalen-2-amine

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)Cl)N(C(=N)N)C(=O)NC)C

DOS

IR

Vibrations