Geometry & MOs

Info

ID:	196985
PubChem CID:	78905566
Reduced:	O2N8C17H18 (1)
Stoich.:	A2B8C17D18 (1)
Weight, g/mol:	272.09277
ΔH_f, kcal/mol:	72.85
Dipole, Da:	5.22
IP(EA), eV:	-9.31(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-(1-hydroxypropan-2-yl)-6-propan-2-yloxypyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCN1C(=O)CN2C=NN=N2)C(=O)C3=CC(=NN3)C4=CC=CC=C4

DOS

IR

Vibrations