Geometry & MOs

Info

ID:	387406
PubChem CID:	134985257
Reduced:	NO2C19H23 (1)
Stoich.:	AB2C19D23 (1)
Weight, g/mol:	169.059974
ΔH_f, kcal/mol:	-40.99
Dipole, Da:	3.09
IP(EA), eV:	-9.09(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-imino-2-methoxy-5-nitroso-5H-pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCCCN1[C@H]([C@@H]1C(=O)OCC)C2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations