Geometry & MOs

Info

ID:	348762
PubChem CID:	127273873
Reduced:	BrO2N5C15H18 (1)
Stoich.:	AB2C5D15E18 (1)
Weight, g/mol:	367.200825
ΔH_f, kcal/mol:	-32.43
Dipole, Da:	2.24
IP(EA), eV:	-9.36(-0.9)
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)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)CCN3C=C(C=CC3=O)Br

DOS

IR

Vibrations