Geometry & MOs

Info

ID:	365920
PubChem CID:	127319185
Reduced:	N2O2C6H9 (2)
Stoich.:	A2B2C6D9 (2)
Weight, g/mol:	320.159689
ΔH_f, kcal/mol:	-185.2
Dipole, Da:	3.26
IP(EA), eV:	-9.66(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2,5-dioxopyrrolidin-1-yl)ethyl]-3-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)urea

Drug info:

PubChemData

Smile

C1CC(C(=O)NC1)NC(=O)NCCN2C(=O)CCC2=O

DOS

IR

Vibrations