Geometry & MOs

Info

ID:	84519
PubChem CID:	49867238
Reduced:	O3N4C8H12 (1)
Stoich.:	A3B4C8D12 (1)
Weight, g/mol:	252.074621
ΔH_f, kcal/mol:	-110.35
Dipole, Da:	2.21
IP(EA), eV:	-9.48(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (3S,4R)-1,4-dihydroxy-2-oxo-3,4-dihydro-1,8-naphthyridine-3-carboxylate

Drug info:

PubChemData

Smile

C1=CN(C(=O)N=C1N)CC[C@@H](C(=O)O)N

DOS

IR

Vibrations