Geometry & MOs

Info

ID:	444671
PubChem CID:	135263193
Reduced:	NSO4C12H13 (1)
Stoich.:	ABC4D12E13 (1)
Weight, g/mol:	290.118591
ΔH_f, kcal/mol:	-125.22
Dipole, Da:	4.51
IP(EA), eV:	-8.99(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-chlorofuran-2-yl)-(4-methyl-2-pyrrolidin-1-ylphenyl)methanamine

Drug info:

PubChemData

Smile

COC(=O)C1(CC1)C2=CC3=C(C=C2)NS(=O)(=O)C3

DOS

IR

Vibrations