Geometry & MOs

Info

ID:	237362
PubChem CID:	92718884
Reduced:	NOC20H29 (1)
Stoich.:	ABC20D29 (1)
Weight, g/mol:	299.152144
ΔH_f, kcal/mol:	-56.71
Dipole, Da:	1.49
IP(EA), eV:	-9.15(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(R)-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-[4-(2-methoxyethyl)phenyl]methanamine

Drug info:

PubChemData

Smile

COCCC1=CC=C(C=C1)[C@@H](C23CC4CC(C2)CC(C4)C3)N

DOS

IR

Vibrations