Geometry & MOs

Info

ID:	354523
PubChem CID:	127287137
Reduced:	ON7C20H35 (1)
Stoich.:	AB7C20D35 (1)
Weight, g/mol:	308.196074
ΔH_f, kcal/mol:	-26.92
Dipole, Da:	3.01
IP(EA), eV:	-8.66(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-methylmorpholin-2-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

CC1CCC(N1CCN2CCN(CC2)C(=O)NC3CCC4=NC(=NN4C3)C)C

DOS

IR

Vibrations