Geometry & MOs

Info

ID:	344375
PubChem CID:	127267551
Reduced:	NO2C8H10 (2)
Stoich.:	AB2C8D10 (2)
Weight, g/mol:	277.142641
ΔH_f, kcal/mol:	-136.43
Dipole, Da:	4.98
IP(EA), eV:	-8.24(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-(6-methyl-2-oxo-1H-pyridin-3-yl)-2-oxoazepane-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1NC(=O)C3CCCCN(C3=O)C)OCO2

DOS

IR

Vibrations