Geometry & MOs

Info

ID:	354518
PubChem CID:	127287132
Reduced:	O2N5C15H25 (1)
Stoich.:	A2B5C15D25 (1)
Weight, g/mol:	320.23246
ΔH_f, kcal/mol:	-68.72
Dipole, Da:	3.3
IP(EA), eV:	-9.4(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN(CC1CCCO1)C(=O)NC2CCC3=NC(=NN3C2)C

DOS

IR

Vibrations