Geometry & MOs

Info

ID:	244015
PubChem CID:	99309293
Reduced:	O3N4C23H28 (1)
Stoich.:	A3B4C23D28 (1)
Weight, g/mol:	489.237604
ΔH_f, kcal/mol:	-68.79
Dipole, Da:	4.44
IP(EA), eV:	-9.03(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-imidazol-1-ylpropanoylamino)-N-[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]benzamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CC(=O)N2CCC(CC2)NC(=O)C3=CN=C(C=C3)NC4CC4

DOS

IR

Vibrations