Geometry & MOs

Info

ID:	352019
PubChem CID:	127282937
Reduced:	ON4C15H24 (1)
Stoich.:	AB4C15D24 (1)
Weight, g/mol:	320.23246
ΔH_f, kcal/mol:	-33.73
Dipole, Da:	5.08
IP(EA), eV:	-8.81(1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCN2CCC(C2C1)NC(=O)N3CCC(CC3)C#N

DOS

IR

Vibrations