Geometry & MOs

Info

ID:	348766
PubChem CID:	127273877
Reduced:	O3N6C19H24 (1)
Stoich.:	A3B6C19D24 (1)
Weight, g/mol:	355.200825
ΔH_f, kcal/mol:	-70.45
Dipole, Da:	5.94
IP(EA), eV:	-8.2(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)NC3=CC(=C(C=C3)OC)N4CCCC4=O

DOS

IR

Vibrations