Geometry & MOs

Info

ID:	347863
PubChem CID:	127272925
Reduced:	ON5C21H29 (1)
Stoich.:	AB5C21D29 (1)
Weight, g/mol:	383.243359
ΔH_f, kcal/mol:	-12.25
Dipole, Da:	6.11
IP(EA), eV:	-8.77(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[2-(4-methylpiperazin-1-yl)pyridin-3-yl]methyl]-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylmethyl)urea

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)N2CCC(C2)NC(=O)NCC3=CN4CCCCC4=N3

DOS

IR

Vibrations