Geometry & MOs

Info

ID:	34178
PubChem CID:	7890182
Reduced:	N3O5C11H15 (1)
Stoich.:	A3B5C11D15 (1)
Weight, g/mol:	345.168856
ΔH_f, kcal/mol:	-119.28
Dipole, Da:	5.08
IP(EA), eV:	-10.04(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-adamantylmethyl)-2-(5-nitro-2-oxopyridin-1-yl)acetamide

Drug info:

PubChemData

Smile

COCCCNC(=O)CN1C=C(C=CC1=O)[N+](=O)[O-]

DOS

IR

Vibrations