Geometry & MOs

Info

ID:	216181
PubChem CID:	85085847
Reduced:	NSO6C7H13 (1)
Stoich.:	ABC6D7E13 (1)
Weight, g/mol:	239.138225
ΔH_f, kcal/mol:	-263.26
Dipole, Da:	3.16
IP(EA), eV:	-9.15(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-6-(hexylamino)-5-nitroso-5H-pyrimidin-4-one

Drug info:

PubChemData

Smile

C(C(C(C1C(C(OC(=S)N1)O)O)O)O)O

DOS

IR

Vibrations