Geometry & MOs

Info

ID:	22782
PubChem CID:	598699
Reduced:	NO2C10H12 (2)
Stoich.:	AB2C10D12 (2)
Weight, g/mol:	356.173607
ΔH_f, kcal/mol:	-131.27
Dipole, Da:	6.08
IP(EA), eV:	-8.73(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[N-[(3-hydroxynaphthalene-2-carbonyl)amino]-C-methylcarbonimidoyl]pentanoate

Drug info:

PubChemData

Smile

CCCC(C(=NNC(=O)C1=CC2=CC=CC=C2C=C1O)C)C(=O)OCC

DOS

IR

Vibrations