Geometry & MOs

Info

ID:	420630
PubChem CID:	135114472
Reduced:	NO2C8H10 (2)
Stoich.:	AB2C8D10 (2)
Weight, g/mol:	352.153541
ΔH_f, kcal/mol:	-102.64
Dipole, Da:	2.77
IP(EA), eV:	-9.51(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,6-dimethyl-N-[(3R,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCC(CNC1=NOC(=C1C(=O)O)C2=CC=CC=C2)OCC

DOS

IR

Vibrations