Geometry & MOs

Info

ID:	84940
PubChem CID:	49870812
Reduced:	ON3C8H10 (2)
Stoich.:	AB3C8D10 (2)
Weight, g/mol:	409.142641
ΔH_f, kcal/mol:	-12.13
Dipole, Da:	3.62
IP(EA), eV:	-8.83(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-hydroxyphenyl)methyl]-8-phenoxy-6-phenyl-7H-imidazo[1,2-a]pyrazin-3-one

Drug info:

PubChemData

Smile

CC(=O)NCC(=O)N1CCN(CC12CC2)C3=NC=NC4=C3C=CN4

DOS

IR

Vibrations