Geometry & MOs

Info

ID:	401730
PubChem CID:	135052296
Reduced:	O8C13H18 (1)
Stoich.:	A8B13C18 (1)
Weight, g/mol:	319.087625
ΔH_f, kcal/mol:	-367.27
Dipole, Da:	4.59
IP(EA), eV:	-10.37(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-methyl-6,8-diphenylimidazo[1,5-a]pyrimidine

Drug info:

PubChemData

Smile

CC(=O)C[C@@H]1[C@H]([C@H]([C@@H](O1)OC(=O)C)OC(=O)C)OC(=O)C

DOS

IR

Vibrations