Geometry & MOs

Info

ID:	348340
PubChem CID:	127273405
Reduced:	O2N4C13H20 (1)
Stoich.:	A2B4C13D20 (1)
Weight, g/mol:	380.196074
ΔH_f, kcal/mol:	-67.34
Dipole, Da:	2.53
IP(EA), eV:	-9.6(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-cyclopropyl-N-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)CC3CCCO3

DOS

IR

Vibrations