Geometry & MOs

Info

ID:	126431
PubChem CID:	50964810
Reduced:	NC2H3 (7)
Stoich.:	AB2C3 (7)
Weight, g/mol:	349.109423
ΔH_f, kcal/mol:	78.47
Dipole, Da:	6.07
IP(EA), eV:	-8.86(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-5-[[5-(5-methyl-1H-pyrazol-3-yl)-4-phenylimidazol-1-yl]methyl]pyridine

Drug info:

PubChemData

Smile

CC1=NC=CN1CCN(C)C2=NC(=NC(=C2)NC3CC3)N

DOS

IR

Vibrations