Geometry & MOs

Info

ID:	224289
PubChem CID:	85341135
Reduced:	NO6C13H17 (1)
Stoich.:	AB6C13D17 (1)
Weight, g/mol:	283.153206
ΔH_f, kcal/mol:	-205.11
Dipole, Da:	1.16
IP(EA), eV:	-9.81(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-1-[[4-(3-hydroxypropyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]pyrimidin-2-one

Drug info:

PubChemData

Smile

C1C(C(C(ON1C(=O)OCC2=CC=CC=C2)CO)O)O

DOS

IR

Vibrations