Geometry & MOs

Info

ID:	14161
PubChem CID:	405428
Reduced:	ON4C22H22 (1)
Stoich.:	AB4C22D22 (1)
Weight, g/mol:	358.179361
ΔH_f, kcal/mol:	63.94
Dipole, Da:	5.74
IP(EA), eV:	-8.49(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-phenyl-2-piperidin-1-yl-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carbaldehyde

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=NC3=NC4=CC=CC=C4N3C(C2C=O)C5=CC=CC=C5

DOS

IR

Vibrations