Geometry & MOs

Info

ID:	126707
PubChem CID:	50974325
Reduced:	ON6C16H24 (1)
Stoich.:	AB6C16D24 (1)
Weight, g/mol:	371.17461
ΔH_f, kcal/mol:	10.7
Dipole, Da:	2.17
IP(EA), eV:	-8.43(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-3-[[5-(5-methyl-1H-pyrazol-3-yl)-4-phenylimidazol-1-yl]methyl]benzamide

Drug info:

PubChemData

Smile

CCN1C(=C(C(=N1)C)NC(=O)CNC(C)CC2=NC=CN=C2)C

DOS

IR

Vibrations