Geometry & MOs

Info

ID:	189821
PubChem CID:	77909145
Reduced:	N3O5H23C28 (1)
Stoich.:	A3B5C23D28 (1)
Weight, g/mol:	393.184112
ΔH_f, kcal/mol:	-58.8
Dipole, Da:	2.13
IP(EA), eV:	-8.81(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-benzylidene-1-methyl-2,7-diphenyl-6,7-dihydro-2H-imidazo[1,2-a]pyrimidin-5-one

Drug info:

PubChemData

Smile

C1C(N=C2N(CC(=CC3=CC=CC=C3)N2C1=O)CC4=CC5=C(C=C4)OCO5)C6=CC7=C(C=C6)OCO7

DOS

IR

Vibrations