Geometry & MOs

Info

ID:	414163
PubChem CID:	135087119
Reduced:	ClSN2O5H9C13 (1)
Stoich.:	ABC2D5E9F13 (1)
Weight, g/mol:	227.131014
ΔH_f, kcal/mol:	-2.06
Dipole, Da:	4.47
IP(EA), eV:	-9.98(-2.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(furan-2-yl)-N-[(1S)-2-methyl-1-phenylpropyl]methanimine

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C2N(O2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])Cl

DOS

IR

Vibrations