Geometry & MOs

Info

ID:	70727
PubChem CID:	48413781
Reduced:	N3O4C19H21 (1)
Stoich.:	A3B4C19D21 (1)
Weight, g/mol:	337.117489
ΔH_f, kcal/mol:	-116.52
Dipole, Da:	8.11
IP(EA), eV:	-9.22(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(furan-2-yl)-3-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)NCC3=C(NN=C3)C

DOS

IR

Vibrations