Geometry & MOs

Info

ID:	348369
PubChem CID:	127273434
Reduced:	ON6C16H24 (1)
Stoich.:	AB6C16D24 (1)
Weight, g/mol:	330.124739
ΔH_f, kcal/mol:	1.6
Dipole, Da:	2.74
IP(EA), eV:	-9.23(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chlorophenyl)-N-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)C(C)C(=O)NC2CCC3=NC(=NN3C2)C

DOS

IR

Vibrations