Geometry & MOs

Info

ID:	355523
PubChem CID:	127288586
Reduced:	ON6C18H30 (1)
Stoich.:	AB6C18D30 (1)
Weight, g/mol:	299.17461
ΔH_f, kcal/mol:	2.21
Dipole, Da:	5.49
IP(EA), eV:	-8.47(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methylphenyl)-2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-ylamino)propanamide

Drug info:

PubChemData

Smile

CC(C(=O)N1CCC(CC1)N(C)C2=NN=CC=C2)N3CCN(CC3)C

DOS

IR

Vibrations