Geometry & MOs

Info

ID:	444649
PubChem CID:	135263134
Reduced:	SN2O4C29H34 (1)
Stoich.:	AB2C4D29E34 (1)
Weight, g/mol:	257.037419
ΔH_f, kcal/mol:	-111.68
Dipole, Da:	4.34
IP(EA), eV:	-8.65(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-chlorofuran-2-yl)-(4-methylphenyl)methanamine;hydrochloride

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(C2=CC=C(O2)C)NC(=O)C3(CCC3)C4=CC=C(C=C4)N5CCS(=O)(=O)CC5)C

DOS

IR

Vibrations