Geometry & MOs

Info

ID:	290276
PubChem CID:	104426386
Reduced:	O3N5C13H23 (1)
Stoich.:	A3B5C13D23 (1)
Weight, g/mol:	266.174276
ΔH_f, kcal/mol:	-50.5
Dipole, Da:	9.32
IP(EA), eV:	-9.18(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(6-ethoxypyrimidin-4-yl)amino]-N-(2-methylpropyl)propanamide

Drug info:

PubChemData

Smile

CCN1C(=C(C(=N1)C)[N+](=O)[O-])NCCC(=O)NCC(C)C

DOS

IR

Vibrations