Geometry & MOs

Info

ID:	244944
PubChem CID:	99431643
Reduced:	N4O5C22H26 (1)
Stoich.:	A4B5C22D26 (1)
Weight, g/mol:	419.232125
ΔH_f, kcal/mol:	-99.95
Dipole, Da:	5.11
IP(EA), eV:	-8.53(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[(3S)-1-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetyl]piperidin-3-yl]methyl]-3-(4-methylphenyl)urea

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)NC[C@H]2CCCN(C2)C(=O)C3=C(C=CC(=C3)OC)[N+](=O)[O-]

DOS

IR

Vibrations