Geometry & MOs

Info

ID:	444687
PubChem CID:	135263267
Reduced:	ClN2O2C18H23 (1)
Stoich.:	AB2C2D18E23 (1)
Weight, g/mol:	298.168128
ΔH_f, kcal/mol:	-48.64
Dipole, Da:	5.77
IP(EA), eV:	-8.81(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3-azabicyclo[3.1.0]hexan-3-yl)-4-methoxyphenyl]-(5-methylfuran-2-yl)methanamine

Drug info:

PubChemData

Smile

CC1=CC=C(O1)C(C2=C(C=C(C=C2)OC)N3CC4CC4C3)N.Cl

DOS

IR

Vibrations