Geometry & MOs

Info

ID:	199456
PubChem CID:	79248437
Reduced:	FION2C11H16 (1)
Stoich.:	ABCD2E11F16 (1)
Weight, g/mol:	263.188529
ΔH_f, kcal/mol:	-72.9
Dipole, Da:	5.15
IP(EA), eV:	-8.43(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-2-methylbutan-2-ol

Drug info:

PubChemData

Smile

CC(C)[C@@H](CO)NC1=CC(=C(C=C1N)I)F

DOS

IR

Vibrations