Geometry & MOs

Info

ID:	1845
PubChem CID:	5171
Reduced:	FN3H16C18 (1)
Stoich.:	AB3C16D18 (1)
Weight, g/mol:	293.132826
ΔH_f, kcal/mol:	55.91
Dipole, Da:	5.64
IP(EA), eV:	-8.93(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(cyclopropylmethyl)-5-(4-fluorophenyl)imidazol-4-yl]pyridine

Drug info:

PubChemData

Smile

C1CC1CN2C=NC(=C2C3=CC=NC=C3)C4=CC=C(C=C4)F

DOS

IR

Vibrations