Geometry & MOs

Info

ID:	343535
PubChem CID:	127266708
Reduced:	O3N6C11H14 (1)
Stoich.:	A3B6C11D14 (1)
Weight, g/mol:	313.153875
ΔH_f, kcal/mol:	4.19
Dipole, Da:	5.1
IP(EA), eV:	-9.45(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(4-amino-7,8-dihydro-5H-1,6-naphthyridin-6-yl)-4-methylpyrimidine-5-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C(=NC=C1)NCCCN2C=NNC2=O)[N+](=O)[O-]

DOS

IR

Vibrations