Geometry & MOs

Info

ID:	201201
PubChem CID:	79504924
Reduced:	OCl2N3C12H15 (1)
Stoich.:	AB2C3D12E15 (1)
Weight, g/mol:	263.14339
ΔH_f, kcal/mol:	-14.9
Dipole, Da:	3.18
IP(EA), eV:	-9.3(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-fluorophenyl)-1-(oxolan-2-ylmethyl)-4,5-dihydroimidazol-2-amine

Drug info:

PubChemData

Smile

COCCN1C(CN=C1N)C2=C(C=C(C=C2)Cl)Cl

DOS

IR

Vibrations