Geometry & MOs

Info

ID:

262758

PubChem CID:

103314540

Reduced:

ON3C17H21 (1)

Stoich.:

AB3C17D21 (1)

Weight, g/mol:

231.137162

ΔHf, kcal/mol:

-1.99

Dipole, Da:

2.81

IP(EA), eV:

-9.01(-0.22)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

5-(4-methoxyphenyl)-1,2,3,5,6,7-hexahydroimidazo[1,2-a]pyrimidine

Drug info:

PubChemData

Smile

CCC1=CC(=NN1C2CCC3=CC=CC=C3NC2=O)CC

DOS

IR

Vibrations