Geometry & MOs

Info

ID:	352099
PubChem CID:	127283167
Reduced:	ON5C17H29 (1)
Stoich.:	AB5C17D29 (1)
Weight, g/mol:	320.23246
ΔH_f, kcal/mol:	-50.85
Dipole, Da:	2.44
IP(EA), eV:	-9.48(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-1-[(1-methylpiperidin-4-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

CC1=NN2CC(CCC2=N1)NC(=O)NC3CCCC(C3)C(C)C

DOS

IR

Vibrations