Geometry & MOs

Info

ID:	177618
PubChem CID:	76204025
Reduced:	NOC4H7 (3)
Stoich.:	ABC4D7 (3)
Weight, g/mol:	238.131742
ΔH_f, kcal/mol:	-165.17
Dipole, Da:	7.4
IP(EA), eV:	-9.36(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-hydroxypropyl)-2-oxo-N-propan-2-yl-3H-pyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C(C1)N)NC(=O)C2CC(NC(=O)C2)O

DOS

IR

Vibrations