Geometry & MOs

Info

ID:	88685
PubChem CID:	49956064
Reduced:	ClNO2C14H17 (1)
Stoich.:	ABC2D14E17 (1)
Weight, g/mol:	328.110432
ΔH_f, kcal/mol:	-3.78
Dipole, Da:	2.57
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.750083
Charge, e:	-1

Chem-info

IUPAC name:

N-(furan-2-ylmethyl)-1-(3-phenylmethoxyphenyl)methanamine;chloride

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1CNCC2=CC=CO2.[Cl-]

DOS

IR

Vibrations