Geometry & MOs

Info

ID:	348551
PubChem CID:	127273662
Reduced:	ClO2N5C18H20 (1)
Stoich.:	AB2C5D18E20 (1)
Weight, g/mol:	375.150681
ΔH_f, kcal/mol:	-39.52
Dipole, Da:	3.11
IP(EA), eV:	-9.07(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)C3CCN(C3=O)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations