Geometry & MOs

Info

ID:	371226
PubChem CID:	127344392
Reduced:	O2N4C15H28 (1)
Stoich.:	A2B4C15D28 (1)
Weight, g/mol:	348.26376
ΔH_f, kcal/mol:	-116.27
Dipole, Da:	0.87
IP(EA), eV:	-8.65(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN1CCCC(C1)CNC(=O)NC2CCC(=O)N(C2)C

DOS

IR

Vibrations