Geometry & MOs

Info

ID:	348275
PubChem CID:	127273340
Reduced:	OSN5C20H23 (1)
Stoich.:	ABC5D20E23 (1)
Weight, g/mol:	378.141594
ΔH_f, kcal/mol:	24.21
Dipole, Da:	1.28
IP(EA), eV:	-8.85(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=C(SC(=N2)C)CC(=O)NC3CCC4=NC(=NN4C3)C

DOS

IR

Vibrations