Geometry & MOs

Info

ID:	164461
PubChem CID:	74403047
Reduced:	SN5O5C15H19 (1)
Stoich.:	AB5C5D15E19 (1)
Weight, g/mol:	499.238353
ΔH_f, kcal/mol:	-131.82
Dipole, Da:	6.16
IP(EA), eV:	-9.14(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(cyclopropylmethyl)-6-(4-fluorophenyl)-2-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-6-methyl-5,7-dihydroimidazo[1,2-a]pyrimidin-3-one

Drug info:

PubChemData

Smile

C1C(C(C(C(O1)NC(=S)NNC(=O)CN2C=NC3=CC=CC=C32)O)O)O

DOS

IR

Vibrations