Geometry & MOs

Info

ID:	201238
PubChem CID:	79510416
Reduced:	SF3N3C13H16 (1)
Stoich.:	AB3C3D13E16 (1)
Weight, g/mol:	245.189198
ΔH_f, kcal/mol:	-126.82
Dipole, Da:	5.01
IP(EA), eV:	-9.22(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-5-(2-methylpropyl)-5-phenyl-4H-imidazol-2-amine

Drug info:

PubChemData

Smile

CCCN1C(CN=C1N)C2=CC=C(C=C2)SC(F)(F)F

DOS

IR

Vibrations