Geometry & MOs

Info

ID:	261580
PubChem CID:	103241421
Reduced:	N3O3C8H11 (1)
Stoich.:	A3B3C8D11 (1)
Weight, g/mol:	237.147727
ΔH_f, kcal/mol:	-46.95
Dipole, Da:	4.77
IP(EA), eV:	-10.12(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-4-[3-(dimethylamino)propoxy]-1H-pyrimidin-6-one

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CNC/C=C/C(=O)O

DOS

IR

Vibrations