Geometry & MOs

Info

ID:	296029
PubChem CID:	117551792
Reduced:	N3C16H21 (1)
Stoich.:	A3B16C21 (1)
Weight, g/mol:	319.06841
ΔH_f, kcal/mol:	23.15
Dipole, Da:	2.77
IP(EA), eV:	-8.45(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-bromophenyl)-5-methyl-2-(pyrrolidin-3-ylmethyl)-1H-imidazole

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2=C(NC(=N2)CC3CCCN3)C

DOS

IR

Vibrations