Geometry & MOs

Info

ID:	185611
PubChem CID:	77320171
Reduced:	Cl2N3O4C22H25 (1)
Stoich.:	A2B3C4D22E25 (1)
Weight, g/mol:	437.127297
ΔH_f, kcal/mol:	-159.55
Dipole, Da:	4.76
IP(EA), eV:	-9.18(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-4-(2-phenyl-2-pyrrolidin-3-yloxyethyl)-1-benzofuran-5-carboximidamide;dihydrochloride

Drug info:

PubChemData

Smile

C1CNCC1OC2=C(C=C(C=C2)CCC(=O)O)C3=CC4=C(O3)C=CC(=C4)C(=N)N.Cl.Cl

DOS

IR

Vibrations