Geometry & MOs

Info

ID:	341921
PubChem CID:	127264614
Reduced:	ClNO2C11H18 (1)
Stoich.:	ABC2D11E18 (1)
Weight, g/mol:	219.021769
ΔH_f, kcal/mol:	-105.61
Dipole, Da:	4.01
IP(EA), eV:	-8.72(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-8-chloro-3,4-dihydro-2H-chromen-4-amine;hydrochloride

Drug info:

PubChemData

Smile

CC[C@@H](C1=CC(=CC(=C1)OC)OC)N.Cl

DOS

IR

Vibrations