Geometry & MOs

Info

ID:	376999
PubChem CID:	134223034
Reduced:	NOC11H15 (1)
Stoich.:	ABC11D15 (1)
Weight, g/mol:	205.146664
ΔH_f, kcal/mol:	-35.99
Dipole, Da:	2.02
IP(EA), eV:	-9.15(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(2-methylpropyl)-3,4-dihydro-1H-isochromen-4-amine

Drug info:

PubChemData

Smile

C[C@@H]1C2=C(C=CC(=C2)C)C(CO1)N

DOS

IR

Vibrations