Geometry & MOs

Info

ID:	275999
PubChem CID:	103819845
Reduced:	O3N4C9H14 (1)
Stoich.:	A3B4C9D14 (1)
Weight, g/mol:	272.067618
ΔH_f, kcal/mol:	-99.42
Dipole, Da:	4.71
IP(EA), eV:	-9.93(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]-6-chloropyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)C(=O)NCCOCC(=O)N

DOS

IR

Vibrations